Friday, January 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 4-[[[2-[(3-bromobenzoyl)amino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[2-[[(3-bromophenyl)-oxomethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[(3-bromobenzoyl)amino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-[(3-bromophenyl)carbonylamino]ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C17H13BrN3O4-
MOLECULAR WEIGHT: 403.20682
SMILES: C1=CC(=CC(=C1)Br)C(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[(3-chlorobenzoyl)amino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[2-[[(3-chlorophenyl)-oxomethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[(3-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-[(3-chlorophenyl)carbonylamino]ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C17H13ClN3O4-
MOLECULAR WEIGHT: 358.75582
SMILES: C1=CC(=CC(=C1)Cl)C(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[2-[[(3-fluorophenyl)-oxomethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-[(3-fluorophenyl)carbonylamino]ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C17H13FN3O4-
MOLECULAR WEIGHT: 342.301223
SMILES: C1=CC(=CC(=C1)F)C(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazono]methyl]benzoic acid
CAS Name: 4-[[[2-[[(3-fluorophenyl)-oxomethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid
IUPAC NAME: 4-[[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[2-[(3-fluorophenyl)carbonylamino]ethanoylhydrazinylidene]methyl]benzoic acid
MOLECULAR FORMULA: C17H14FN3O4
MOLECULAR WEIGHT: 343.309163
SMILES: C1=CC(=CC(=C1)F)C(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)O
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Product OPENEYE NAME: 4-[[[2-[(4-fluorobenzoyl)amino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[2-[[(4-fluorophenyl)-oxomethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[(4-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-[(4-fluorophenyl)carbonylamino]ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C17H13FN3O4-
MOLECULAR WEIGHT: 342.301223
SMILES: C1=CC(=CC=C1C=NNC(=O)CNC(=O)C2=CC=C(C=C2)F)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[(4-fluorobenzoyl)amino]acetyl]hydrazono]methyl]benzoic acid
CAS Name: 4-[[[2-[[(4-fluorophenyl)-oxomethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid
IUPAC NAME: 4-[[[2-[(4-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[2-[(4-fluorophenyl)carbonylamino]ethanoylhydrazinylidene]methyl]benzoic acid
MOLECULAR FORMULA: C17H14FN3O4
MOLECULAR WEIGHT: 343.309163
SMILES: C1=CC(=CC=C1C=NNC(=O)CNC(=O)C2=CC=C(C=C2)F)C(=O)O
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Product OPENEYE NAME: 4-[[[2-(1,3-benzodioxole-5-carbonylamino)acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-(1,3-benzodioxole-5-carbonylamino)acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C18H14N3O6-
MOLECULAR WEIGHT: 368.32026
SMILES: C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)NN=CC3=CC=C(C=C3)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-(3-phenylprop-2-enoylamino)acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[1-oxo-2-[(1-oxo-3-phenylprop-2-enyl)amino]ethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-(3-phenylprop-2-enoylamino)acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-(3-phenylprop-2-enoylamino)ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C19H16N3O4-
MOLECULAR WEIGHT: 350.34804
SMILES: C1=CC=C(C=C1)C=CC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[3-(2-methoxyphenyl)prop-2-enoylamino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[2-[[3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[3-(2-methoxyphenyl)prop-2-enoylamino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-[3-(2-methoxyphenyl)prop-2-enoylamino]ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C20H18N3O5-
MOLECULAR WEIGHT: 380.37402
SMILES: COC1=CC=CC=C1C=CC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[3-(4-methoxyphenyl)prop-2-enoylamino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[2-[[3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[3-(4-methoxyphenyl)prop-2-enoylamino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-[3-(4-methoxyphenyl)prop-2-enoylamino]ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C20H18N3O5-
MOLECULAR WEIGHT: 380.37402
SMILES: COC1=CC=C(C=C1)C=CC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[3-(4-methoxyphenyl)prop-2-enoylamino]acetyl]hydrazono]methyl]benzoic acid
CAS Name: 4-[[[2-[[3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid
IUPAC NAME: 4-[[[2-[3-(4-methoxyphenyl)prop-2-enoylamino]acetyl]hydrazinylidene]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[2-[3-(4-methoxyphenyl)prop-2-enoylamino]ethanoylhydrazinylidene]methyl]benzoic acid
MOLECULAR FORMULA: C20H19N3O5
MOLECULAR WEIGHT: 381.38196
SMILES: COC1=CC=C(C=C1)C=CC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)O
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Product OPENEYE NAME: 4-[[[2-[(2-phenylacetyl)amino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[1-oxo-2-[(1-oxo-2-phenylethyl)amino]ethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[(2-phenylacetyl)amino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-(2-phenylethanoylamino)ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C18H16N3O4-
MOLECULAR WEIGHT: 338.33734
SMILES: C1=CC=C(C=C1)CC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[(2-phenoxyacetyl)amino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[1-oxo-2-[(1-oxo-2-phenoxyethyl)amino]ethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[(2-phenoxyacetyl)amino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-(2-phenoxyethanoylamino)ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C18H16N3O5-
MOLECULAR WEIGHT: 354.33674
SMILES: C1=CC=C(C=C1)OCC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[[2-(3-methylphenoxy)acetyl]amino]acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[2-[[2-(3-methylphenoxy)-1-oxoethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-[[2-(3-methylphenoxy)acetyl]amino]acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-[2-(3-methylphenoxy)ethanoylamino]ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C19H18N3O5-
MOLECULAR WEIGHT: 368.36332
SMILES: CC1=CC(=CC=C1)OCC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-[[2-(3-methylphenoxy)acetyl]amino]acetyl]hydrazono]methyl]benzoic acid
CAS Name: 4-[[[2-[[2-(3-methylphenoxy)-1-oxoethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid
IUPAC NAME: 4-[[[2-[[2-(3-methylphenoxy)acetyl]amino]acetyl]hydrazinylidene]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[2-[2-(3-methylphenoxy)ethanoylamino]ethanoylhydrazinylidene]methyl]benzoic acid
MOLECULAR FORMULA: C19H19N3O5
MOLECULAR WEIGHT: 369.37126
SMILES: CC1=CC(=CC=C1)OCC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)O
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Product OPENEYE NAME: 4-[[[2-(3-phenylpropanoylamino)acetyl]hydrazono]methyl]benzoate
CAS Name: 4-[[[1-oxo-2-[(1-oxo-3-phenylpropyl)amino]ethyl]hydrazinylidene]methyl]benzoate
IUPAC NAME: 4-[[[2-(3-phenylpropanoylamino)acetyl]hydrazinylidene]methyl]benzoate
SYSTEMATIC NAME: 4-[[2-(3-phenylpropanoylamino)ethanoylhydrazinylidene]methyl]benzoate
MOLECULAR FORMULA: C19H18N3O4-
MOLECULAR WEIGHT: 352.36392
SMILES: C1=CC=C(C=C1)CCC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)[O-]
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Product OPENEYE NAME: 4-[[[2-(3-phenylpropanoylamino)acetyl]hydrazono]methyl]benzoic acid
CAS Name: 4-[[[1-oxo-2-[(1-oxo-3-phenylpropyl)amino]ethyl]hydrazinylidene]methyl]benzoic acid
IUPAC NAME: 4-[[[2-(3-phenylpropanoylamino)acetyl]hydrazinylidene]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[2-(3-phenylpropanoylamino)ethanoylhydrazinylidene]methyl]benzoic acid
MOLECULAR FORMULA: C19H19N3O4
MOLECULAR WEIGHT: 353.37186
SMILES: C1=CC=C(C=C1)CCC(=O)NCC(=O)NN=CC2=CC=C(C=C2)C(=O)O
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Product OPENEYE NAME: N-(cyclopropylmethyl)-N-[2-[[2-(4-methoxyanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]cyclohexanecarboxamide
CAS Name: N-(cyclopropylmethyl)-N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]cyclohexanecarboxamide
IUPAC NAME: N-(cyclopropylmethyl)-N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]cyclohexanecarboxamide
SYSTEMATIC NAME: N-(cyclopropylmethyl)-N-[2-[[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]cyclohexanecarboxamide
MOLECULAR FORMULA: C22H31N3O4
MOLECULAR WEIGHT: 401.49924
SMILES: COC1=CC=C(C=C1)NC(=O)CNC(=O)CN(CC2CC2)C(=O)C3CCCCC3
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Product OPENEYE NAME: N-[2-[(5-methylthiazol-2-yl)amino]-2-oxo-ethyl]-N-pentyl-3-(trifluoromethyl)benzamide
CAS Name: N-[2-[(5-methyl-2-thiazolyl)amino]-2-oxoethyl]-N-pentyl-3-(trifluoromethyl)benzamide
IUPAC NAME: N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-N-pentyl-3-(trifluoromethyl)benzamide
SYSTEMATIC NAME: N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-N-pentyl-3-(trifluoromethyl)benzamide
MOLECULAR FORMULA: C19H22F3N3O2S
MOLECULAR WEIGHT: 413.45709
SMILES: CCCCCN(CC(=O)NC1=NC=C(S1)C)C(=O)C2=CC(=CC=C2)C(F)(F)F
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All Chemical Compounds Information




Product OPENEYE NAME: 2-(2,4-dichlorophenoxy)-N-(4-methoxyphenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]acetamide
CAS Name: 2-(2,4-dichlorophenoxy)-N-(4-methoxyphenyl)-N-[(2-oxo-1-pyrrolidinyl)methyl]acetamide
IUPAC NAME: 2-(2,4-dichlorophenoxy)-N-(4-methoxyphenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]acetamide
SYSTEMATIC NAME: 2-[2,4-bis(chloranyl)phenoxy]-N-(4-methoxyphenyl)-N-[(2-oxidanylidenepyrrolidin-1-yl)methyl]ethanamide
MOLECULAR FORMULA: C20H20Cl2N2O4
MOLECULAR WEIGHT: 423.2898
SMILES: COC1=CC=C(C=C1)N(CN2CCCC2=O)C(=O)COC3=C(C=C(C=C3)Cl)Cl
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Product OPENEYE NAME: N-[(1,2-dimethylindol-5-yl)methyl]-2-methyl-benzamide
CAS Name: N-[(1,2-dimethyl-5-indolyl)methyl]-2-methylbenzamide
IUPAC NAME: N-[(1,2-dimethylindol-5-yl)methyl]-2-methylbenzamide
SYSTEMATIC NAME: N-[(1,2-dimethylindol-5-yl)methyl]-2-methyl-benzamide
MOLECULAR FORMULA: C19H20N2O
MOLECULAR WEIGHT: 292.3749
SMILES: CC1=CC=CC=C1C(=O)NCC2=CC3=C(C=C2)N(C(=C3)C)C
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Product OPENEYE NAME: N-(7-methylthiazolo[5,4-e][1,3]benzothiazol-2-yl)-2-(p-tolylsulfonylamino)benzamide
CAS Name: 2-[(4-methylphenyl)sulfonylamino]-N-(7-methyl-2-thiazolo[5,4-e][1,3]benzothiazolyl)benzamide
IUPAC NAME: 2-[(4-methylphenyl)sulfonylamino]-N-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)benzamide
SYSTEMATIC NAME: 2-[(4-methylphenyl)sulfonylamino]-N-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)benzamide
MOLECULAR FORMULA: C23H18N4O3S3
MOLECULAR WEIGHT: 494.60902
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=NC4=C(S3)C5=C(C=C4)SC(=N5)C
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Product OPENEYE NAME: N-[[4-(2,5-dimethoxyphenyl)-5-[2-oxo-2-(thiazol-2-ylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-(1-piperidylsulfonyl)benzamide
CAS Name: N-[[4-(2,5-dimethoxyphenyl)-5-[[2-oxo-2-(2-thiazolylamino)ethyl]thio]-1,2,4-triazol-3-yl]methyl]-4-(1-piperidinylsulfonyl)benzamide
IUPAC NAME: N-[[4-(2,5-dimethoxyphenyl)-5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-piperidin-1-ylsulfonylbenzamide
SYSTEMATIC NAME: N-[[4-(2,5-dimethoxyphenyl)-5-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide
MOLECULAR FORMULA: C28H31N7O6S3
MOLECULAR WEIGHT: 657.78404
SMILES: COC1=CC(=C(C=C1)OC)N2C(=NN=C2SCC(=O)NC3=NC=CS3)CNC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5
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Product OPENEYE NAME: methyl 4-[[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]carbamoyl]benzoate
CAS Name: 4-[[[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]amino]-oxomethyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]carbamoyl]benzoate
SYSTEMATIC NAME: methyl 4-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]carbamoyl]benzoate
MOLECULAR FORMULA: C19H13N3O3S2
MOLECULAR WEIGHT: 395.45482
SMILES: COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=NC4=CC=CC=C4S3
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Product OPENEYE NAME: 3,4,5-triethoxy-N-[4-(2-oxochromen-3-yl)thiazol-2-yl]benzamide
CAS Name: 3,4,5-triethoxy-N-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]benzamide
IUPAC NAME: 3,4,5-triethoxy-N-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]benzamide
SYSTEMATIC NAME: 3,4,5-triethoxy-N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]benzamide
MOLECULAR FORMULA: C25H24N2O6S
MOLECULAR WEIGHT: 480.53286
SMILES: CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O
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Product OPENEYE NAME: N-[2-(dimethylamino)ethyl]-2-ethyl-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]hexanamide
CAS Name: N-[2-(dimethylamino)ethyl]-2-ethyl-N-[2-(3-isoxazolylamino)-2-oxoethyl]hexanamide
IUPAC NAME: N-[2-(dimethylamino)ethyl]-2-ethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]hexanamide
SYSTEMATIC NAME: N-[2-(dimethylamino)ethyl]-2-ethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]hexanamide
MOLECULAR FORMULA: C17H30N4O3
MOLECULAR WEIGHT: 338.4451
SMILES: CCCCC(CC)C(=O)N(CCN(C)C)CC(=O)NC1=NOC=C1
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Product OPENEYE NAME: N-(4-methoxyphenyl)-2-[8-(2-methylpropanoyl)-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]acetamide
CAS Name: N-(4-methoxyphenyl)-2-[8-(2-methyl-1-oxopropyl)-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]acetamide
IUPAC NAME: N-(4-methoxyphenyl)-2-[8-(2-methylpropanoyl)-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]acetamide
SYSTEMATIC NAME: N-(4-methoxyphenyl)-2-[8-(2-methylpropanoyl)-1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]ethanamide
MOLECULAR FORMULA: C26H32N4O4
MOLECULAR WEIGHT: 464.55668
SMILES: CC(C)C(=O)N1CCC2(CC1)C(=O)N(CN2C3=CC=CC=C3)CC(=O)NC4=CC=C(C=C4)OC
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Product OPENEYE NAME: 3-chloro-N-cyclopropyl-N-[2-[(3,4-dimethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxo-ethyl]benzamide
CAS Name: 3-chloro-N-cyclopropyl-N-[2-[(3,4-dimethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]benzamide
IUPAC NAME: 3-chloro-N-cyclopropyl-N-[2-[(3,4-dimethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]benzamide
SYSTEMATIC NAME: 3-chloranyl-N-cyclopropyl-N-[2-[(3,4-dimethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxidanylidene-ethyl]benzamide
MOLECULAR FORMULA: C31H32ClN3O4
MOLECULAR WEIGHT: 546.05648
SMILES: COC1=C(C=C(C=C1)CN(CCC2=CNC3=CC=CC=C32)C(=O)CN(C4CC4)C(=O)C5=CC(=CC=C5)Cl)OC
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Product OPENEYE NAME: N-benzyl-2-[butyl-[[2-(trifluoromethyl)phenyl]carbamoyl]amino]-N-[2-(1H-indol-3-yl)ethyl]acetamide
CAS Name: 2-[butyl-[oxo-[2-(trifluoromethyl)anilino]methyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-2-[butyl-[[2-(trifluoromethyl)phenyl]carbamoyl]amino]-N-[2-(1H-indol-3-yl)ethyl]acetamide
SYSTEMATIC NAME: 2-[butyl-[[2-(trifluoromethyl)phenyl]carbamoyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C31H33F3N4O2
MOLECULAR WEIGHT: 550.61453
SMILES: CCCCN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(F)(F)F
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Product OPENEYE NAME: N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxo-ethyl]-N-(2-methoxyethyl)-2-methyl-propanamide
CAS Name: N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)-2-methylpropanamide
IUPAC NAME: N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)-2-methylpropanamide
SYSTEMATIC NAME: N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)-2-methyl-propanamide
MOLECULAR FORMULA: C28H37N3O4
MOLECULAR WEIGHT: 479.61108
SMILES: CCOC1=CC=C(C=C1)CN(CCC2=CNC3=CC=CC=C32)C(=O)CN(CCOC)C(=O)C(C)C
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Product OPENEYE NAME: 2-[(2-benzyloxyacetyl)-isopropyl-amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(1-oxo-2-phenylmethoxyethyl)-propan-2-ylamino]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
IUPAC NAME: N-[2-(1H-indol-3-yl)ethyl]-2-[(2-phenylmethoxyacetyl)-propan-2-ylamino]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
SYSTEMATIC NAME: N-[2-(1H-indol-3-yl)ethyl]-2-[2-phenylmethoxyethanoyl(propan-2-yl)amino]-N-[[4-(trifluoromethyl)phenyl]methyl]ethanamide
MOLECULAR FORMULA: C32H34F3N3O3
MOLECULAR WEIGHT: 565.62587
SMILES: CC(C)N(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=C(C=C3)C(F)(F)F)C(=O)COCC4=CC=CC=C4
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Product OPENEYE NAME: N-[2-(1H-indol-3-yl)ethyl]-2-[phenylcarbamoyl(propyl)amino]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CAS Name: 2-[[anilino(oxo)methyl]-propylamino]-N-[2-(1H-indol-3-yl)ethyl]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
IUPAC NAME: N-[2-(1H-indol-3-yl)ethyl]-2-[phenylcarbamoyl(propyl)amino]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
SYSTEMATIC NAME: N-[2-(1H-indol-3-yl)ethyl]-2-[phenylcarbamoyl(propyl)amino]-N-[[4-(trifluoromethyl)phenyl]methyl]ethanamide
MOLECULAR FORMULA: C30H31F3N4O2
MOLECULAR WEIGHT: 536.58795
SMILES: CCCN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=C(C=C3)C(F)(F)F)C(=O)NC4=CC=CC=C4
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Product OPENEYE NAME: N-[2-[(4-fluorophenyl)methyl-[(5-methyl-2-furyl)methyl]amino]-2-oxo-ethyl]-N-(tetrahydrofuran-2-ylmethyl)-3-(trifluoromethyl)benzamide
CAS Name: N-[2-[(4-fluorophenyl)methyl-[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-N-(2-oxolanylmethyl)-3-(trifluoromethyl)benzamide
IUPAC NAME: N-[2-[(4-fluorophenyl)methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-N-(oxolan-2-ylmethyl)-3-(trifluoromethyl)benzamide
SYSTEMATIC NAME: N-[2-[(4-fluorophenyl)methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(oxolan-2-ylmethyl)-3-(trifluoromethyl)benzamide
MOLECULAR FORMULA: C28H28F4N2O4
MOLECULAR WEIGHT: 532.526533
SMILES: CC1=CC=C(O1)CN(CC2=CC=C(C=C2)F)C(=O)CN(CC3CCCO3)C(=O)C4=CC(=CC=C4)C(F)(F)F
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Product OPENEYE NAME: N',N'-dimethyl-N-(4-methylsulfonylphenyl)ethane-1,2-diamine
CAS Name: N',N'-dimethyl-N-(4-methylsulfonylphenyl)ethane-1,2-diamine
IUPAC NAME: N',N'-dimethyl-N-(4-methylsulfonylphenyl)ethane-1,2-diamine
SYSTEMATIC NAME: N',N'-dimethyl-N-(4-methylsulfonylphenyl)ethane-1,2-diamine
MOLECULAR FORMULA: C11H18N2O2S
MOLECULAR WEIGHT: 242.33782
SMILES: CN(C)CCNC1=CC=C(C=C1)S(=O)(=O)C
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Product OPENEYE NAME: N-(4-tert-butylphenyl)-3-(4-chlorophenyl)prop-2-enamide
CAS Name: N-(4-tert-butylphenyl)-3-(4-chlorophenyl)-2-propenamide
IUPAC NAME: N-(4-tert-butylphenyl)-3-(4-chlorophenyl)prop-2-enamide
SYSTEMATIC NAME: N-(4-tert-butylphenyl)-3-(4-chlorophenyl)prop-2-enamide
MOLECULAR FORMULA: C19H20ClNO
MOLECULAR WEIGHT: 313.8212
SMILES: CC(C)(C)C1=CC=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: [4-bromo-2-[[(2,4-dichlorobenzoyl)hydrazono]methyl]phenyl] 2,2-dimethylpropanoate
CAS Name: 2,2-dimethylpropanoic acid [4-bromo-2-[[[(2,4-dichlorophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester
IUPAC NAME: [4-bromo-2-[[(2,4-dichlorobenzoyl)hydrazinylidene]methyl]phenyl] 2,2-dimethylpropanoate
SYSTEMATIC NAME: [4-bromanyl-2-[[(2,4-dichlorophenyl)carbonylhydrazinylidene]methyl]phenyl] 2,2-dimethylpropanoate
MOLECULAR FORMULA: C19H17BrCl2N2O3
MOLECULAR WEIGHT: 472.15988
SMILES: CC(C)(C)C(=O)OC1=C(C=C(C=C1)Br)C=NNC(=O)C2=C(C=C(C=C2)Cl)Cl
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Product OPENEYE NAME: 3-[4-(3-carboxypropanoylamino)phenyl]sulfonylthiazolidine-2-carboxylic acid
CAS Name: 3-[4-[(3-carboxy-1-oxopropyl)amino]phenyl]sulfonyl-2-thiazolidinecarboxylic acid
IUPAC NAME: 3-[4-(3-carboxypropanoylamino)phenyl]sulfonyl-1,3-thiazolidine-2-carboxylic acid
SYSTEMATIC NAME: 3-[4-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]phenyl]sulfonyl-1,3-thiazolidine-2-carboxylic acid
MOLECULAR FORMULA: C14H16N2O7S2
MOLECULAR WEIGHT: 388.41604
SMILES: C1CSC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O)C(=O)O
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Product OPENEYE NAME: 3,4-dibutoxy-N-isopropyl-benzamide
CAS Name: 3,4-dibutoxy-N-propan-2-ylbenzamide
IUPAC NAME: 3,4-dibutoxy-N-propan-2-ylbenzamide
SYSTEMATIC NAME: 3,4-dibutoxy-N-propan-2-yl-benzamide
MOLECULAR FORMULA: C18H29NO3
MOLECULAR WEIGHT: 307.42776
SMILES: CCCCOC1=C(C=C(C=C1)C(=O)NC(C)C)OCCCC
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Product OPENEYE NAME: 8-methyl-7-[[(4-phenylthiazol-2-yl)amino]methyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one
CAS Name: 8-methyl-7-[[(4-phenyl-2-thiazolyl)amino]methyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one
IUPAC NAME: 8-methyl-7-[[(4-phenyl-1,3-thiazol-2-yl)amino]methyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one
SYSTEMATIC NAME: 8-methyl-7-[[(4-phenyl-1,3-thiazol-2-yl)amino]methyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one
MOLECULAR FORMULA: C16H14N6OS
MOLECULAR WEIGHT: 338.38696
SMILES: CC1=C(C(=O)NN2C1=NN=C2)CNC3=NC(=CS3)C4=CC=CC=C4
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Product OPENEYE NAME: 4-[(6-chloro-1,3-benzodioxol-5-yl)methylene]-1-(4-chlorophenyl)pyrazolidine-3,5-dione
CAS Name: 4-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-1-(4-chlorophenyl)pyrazolidine-3,5-dione
IUPAC NAME: 4-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-1-(4-chlorophenyl)pyrazolidine-3,5-dione
SYSTEMATIC NAME: 4-[(6-chloranyl-1,3-benzodioxol-5-yl)methylidene]-1-(4-chlorophenyl)pyrazolidine-3,5-dione
MOLECULAR FORMULA: C17H10Cl2N2O4
MOLECULAR WEIGHT: 377.1783
SMILES: C1OC2=C(O1)C=C(C(=C2)C=C3C(=O)NN(C3=O)C4=CC=C(C=C4)Cl)Cl
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Product OPENEYE NAME: dicyclohexyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium
CAS Name: dicyclohexyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium
IUPAC NAME: dicyclohexyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium
SYSTEMATIC NAME: dicyclohexyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium
MOLECULAR FORMULA: C23H37N2O+
MOLECULAR WEIGHT: 357.55268
SMILES: CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](C2CCCCC2)C3CCCCC3)C
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Product OPENEYE NAME: N-decyl-2-[2-(decylamino)-2-oxo-ethoxy]acetamide
CAS Name: N-decyl-2-[2-(decylamino)-2-oxoethoxy]acetamide
IUPAC NAME: N-decyl-2-[2-(decylamino)-2-oxoethoxy]acetamide
SYSTEMATIC NAME: N-decyl-2-[2-(decylamino)-2-oxidanylidene-ethoxy]ethanamide
MOLECULAR FORMULA: C24H48N2O3
MOLECULAR WEIGHT: 412.64952
SMILES: CCCCCCCCCCNC(=O)COCC(=O)NCCCCCCCCCC
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Product OPENEYE NAME: (1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)-(4-fluorophenyl)methanone
CAS Name: (1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)-(4-fluorophenyl)methanone
IUPAC NAME: (1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)-(4-fluorophenyl)methanone
SYSTEMATIC NAME: (1-azanyl-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)-(4-fluorophenyl)methanone
MOLECULAR FORMULA: C20H19FN2OS
MOLECULAR WEIGHT: 354.441063
SMILES: CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)C4=CC=C(C=C4)F)N
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Product OPENEYE NAME: 2-(2,4-dimethylphenyl)-N-[2-[[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]amino]phenyl]quinoline-4-carboxamide
CAS Name: 2-(2,4-dimethylphenyl)-N-[2-[[[2-(2,4-dimethylphenyl)-4-quinolinyl]-oxomethyl]amino]phenyl]-4-quinolinecarboxamide
IUPAC NAME: 2-(2,4-dimethylphenyl)-N-[2-[[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]amino]phenyl]quinoline-4-carboxamide
SYSTEMATIC NAME: 2-(2,4-dimethylphenyl)-N-[2-[[2-(2,4-dimethylphenyl)quinolin-4-yl]carbonylamino]phenyl]quinoline-4-carboxamide
MOLECULAR FORMULA: C42H34N4O2
MOLECULAR WEIGHT: 626.74496
SMILES: CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4NC(=O)C5=CC(=NC6=CC=CC=C65)C7=C(C=C(C=C7)C)C)C
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Product OPENEYE NAME: N-(4-nitrophenyl)-5-oxo-thiazolo[3,2-a]pyrimidine-6-carboxamide
CAS Name: N-(4-nitrophenyl)-5-oxo-6-thiazolo[3,2-a]pyrimidinecarboxamide
IUPAC NAME: N-(4-nitrophenyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SYSTEMATIC NAME: N-(4-nitrophenyl)-5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
MOLECULAR FORMULA: C13H8N4O4S
MOLECULAR WEIGHT: 316.29202
SMILES: C1=CC(=CC=C1NC(=O)C2=CN=C3N(C2=O)C=CS3)[N+](=O)[O-]
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Product OPENEYE NAME: ethyl 5-(butanoylamino)-4-oxo-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylate
CAS Name: 3-(4-methylphenyl)-4-oxo-5-(1-oxobutylamino)-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 5-(butanoylamino)-3-(4-methylphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate
SYSTEMATIC NAME: ethyl 5-(butanoylamino)-3-(4-methylphenyl)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate
MOLECULAR FORMULA: C20H21N3O4S
MOLECULAR WEIGHT: 399.46344
SMILES: CCCC(=O)NC1=C2C(=CS1)C(=NN(C2=O)C3=CC=C(C=C3)C)C(=O)OCC
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Product OPENEYE NAME: ethyl 3-(4-methoxyphenyl)-4-oxo-5-[[2-(4-phenylphenyl)acetyl]amino]thieno[3,4-d]pyridazine-1-carboxylate
CAS Name: 3-(4-methoxyphenyl)-4-oxo-5-[[1-oxo-2-(4-phenylphenyl)ethyl]amino]-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-(4-methoxyphenyl)-4-oxo-5-[[2-(4-phenylphenyl)acetyl]amino]thieno[3,4-d]pyridazine-1-carboxylate
SYSTEMATIC NAME: ethyl 3-(4-methoxyphenyl)-4-oxidanylidene-5-[2-(4-phenylphenyl)ethanoylamino]thieno[3,4-d]pyridazine-1-carboxylate
MOLECULAR FORMULA: C30H25N3O5S
MOLECULAR WEIGHT: 539.6016
SMILES: CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=C(C=C5)OC
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All Chemical Compounds Information




Product OPENEYE NAME: N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-[(3-methyl-1-piperidyl)sulfonyl]benzamide
CAS Name: N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide
IUPAC NAME: N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-(3-methylpiperidin-1-yl)sulfonylbenzamide
SYSTEMATIC NAME: N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide
MOLECULAR FORMULA: C22H24N4O5S
MOLECULAR WEIGHT: 456.51476
SMILES: CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(O3)C4=CC=CC=C4OC
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Product OPENEYE NAME: 4-(5-bromo-2-chloro-benzoyl)-7-chloro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
CAS Name: 4-[(5-bromo-2-chlorophenyl)-oxomethyl]-7-chloro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
IUPAC NAME: 4-(5-bromo-2-chlorobenzoyl)-7-chloro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 4-(5-bromanyl-2-chloranyl-phenyl)carbonyl-7-chloranyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C22H15BrCl2N2O2
MOLECULAR WEIGHT: 490.1767
SMILES: C1C(=O)NC2=C(C=C(C=C2)Cl)C(N1C(=O)C3=C(C=CC(=C3)Br)Cl)C4=CC=CC=C4
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Product OPENEYE NAME: 4-[[4-[(2,6-difluorophenyl)methyl]-1,2,3,3a-tetrahydropyrrolo[1,2-a]benzimidazol-6-yl]sulfonyl]morpholine
CAS Name: 4-[[4-[(2,6-difluorophenyl)methyl]-1,2,3,3a-tetrahydropyrrolo[1,2-a]benzimidazol-6-yl]sulfonyl]morpholine
IUPAC NAME: 4-[[4-[(2,6-difluorophenyl)methyl]-1,2,3,3a-tetrahydropyrrolo[1,2-a]benzimidazol-6-yl]sulfonyl]morpholine
SYSTEMATIC NAME: 4-[[4-[[2,6-bis(fluoranyl)phenyl]methyl]-1,2,3,3a-tetrahydropyrrolo[1,2-a]benzimidazol-6-yl]sulfonyl]morpholine
MOLECULAR FORMULA: C21H23F2N3O3S
MOLECULAR WEIGHT: 435.487426
SMILES: C1CC2N(C1)C3=C(N2CC4=C(C=CC=C4F)F)C=C(C=C3)S(=O)(=O)N5CCOCC5
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Product OPENEYE NAME: N-(2-bromo-4-methyl-phenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]prop-2-enamide
CAS Name: N-(2-bromo-4-methylphenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-propenamide
IUPAC NAME: N-(2-bromo-4-methylphenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]prop-2-enamide
SYSTEMATIC NAME: N-(2-bromanyl-4-methyl-phenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]prop-2-enamide
MOLECULAR FORMULA: C23H21BrN2O4S
MOLECULAR WEIGHT: 501.39284
SMILES: CC1=CC(=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)OC)Br
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Product OPENEYE NAME: N-allyl-4-(4-nitrophenyl)-3-[(4-phenylcyclohexylidene)amino]thiazol-2-imine
CAS Name: 4-(4-nitrophenyl)-3-[(4-phenylcyclohexylidene)amino]-N-prop-2-enyl-2-thiazolimine
IUPAC NAME: 4-(4-nitrophenyl)-3-[(4-phenylcyclohexylidene)amino]-N-prop-2-enyl-1,3-thiazol-2-imine
SYSTEMATIC NAME: 4-(4-nitrophenyl)-3-[(4-phenylcyclohexylidene)amino]-N-prop-2-enyl-1,3-thiazol-2-imine
MOLECULAR FORMULA: C24H24N4O2S
MOLECULAR WEIGHT: 432.53796
SMILES: C=CCN=C1N(C(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])N=C3CCC(CC3)C4=CC=CC=C4
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Product OPENEYE NAME: N-(2-chlorophenyl)-2-[2-[(2,4-dipropoxyphenyl)methylene]hydrazino]-5-nitro-benzenesulfonamide
CAS Name: N-(2-chlorophenyl)-2-[2-[(2,4-dipropoxyphenyl)methylidene]hydrazinyl]-5-nitrobenzenesulfonamide
IUPAC NAME: N-(2-chlorophenyl)-2-[2-[(2,4-dipropoxyphenyl)methylidene]hydrazinyl]-5-nitrobenzenesulfonamide
SYSTEMATIC NAME: N-(2-chlorophenyl)-2-[2-[(2,4-dipropoxyphenyl)methylidene]hydrazinyl]-5-nitro-benzenesulfonamide
MOLECULAR FORMULA: C25H27ClN4O6S
MOLECULAR WEIGHT: 547.02308
SMILES: CCCOC1=CC(=C(C=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=CC=C3Cl)OCCC
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Product OPENEYE NAME: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-(2,3,4-trichlorophenyl)quinoline-4-carboxamide
CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-(2,3,4-trichlorophenyl)-4-quinolinecarboxamide
IUPAC NAME: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-(2,3,4-trichlorophenyl)quinoline-4-carboxamide
SYSTEMATIC NAME: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-[2,3,4-tris(chloranyl)phenyl]quinoline-4-carboxamide
MOLECULAR FORMULA: C26H19Cl3N4O3S
MOLECULAR WEIGHT: 573.87806
SMILES: C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=C(C(=C(C=C5)Cl)Cl)Cl
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Product OPENEYE NAME: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-phenyl-2-quinazolin-4-ylsulfanyl-acetamide
CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-phenyl-2-(4-quinazolinylthio)acetamide
IUPAC NAME: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-phenyl-2-quinazolin-4-ylsulfanylacetamide
SYSTEMATIC NAME: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-phenyl-2-quinazolin-4-ylsulfanyl-ethanamide
MOLECULAR FORMULA: C23H15ClF3N3OS
MOLECULAR WEIGHT: 473.89791
SMILES: C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)SC3=NC=NC4=CC=CC=C43
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Product OPENEYE NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-N-(3-methoxypropyl)-1,3-benzodioxole-5-carboxamide
CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(3-methoxypropyl)-1,3-benzodioxole-5-carboxamide
IUPAC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(3-methoxypropyl)-1,3-benzodioxole-5-carboxamide
SYSTEMATIC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)-1,3-benzodioxole-5-carboxamide
MOLECULAR FORMULA: C27H28N2O7S
MOLECULAR WEIGHT: 524.58542
SMILES: COCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)C4=CC5=C(C=C4)OCO5
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Product OPENEYE NAME: 2-(4-fluorophenyl)-N-[2-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-N-sec-butyl-acetamide
CAS Name: N-butan-2-yl-2-(4-fluorophenyl)-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]acetamide
IUPAC NAME: N-butan-2-yl-2-(4-fluorophenyl)-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]acetamide
SYSTEMATIC NAME: N-butan-2-yl-2-(4-fluorophenyl)-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]ethanamide
MOLECULAR FORMULA: C26H28F2N2O2S
MOLECULAR WEIGHT: 470.574526
SMILES: CCC(C)N(CC(=O)N(CC1=CC=C(C=C1)F)CC2=CC=CS2)C(=O)CC3=CC=C(C=C3)F
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Product OPENEYE NAME: 2-[(2-chloroacetyl)-isopropyl-amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methyl-2-thienyl)methyl]acetamide
CAS Name: 2-[(2-chloro-1-oxoethyl)-propan-2-ylamino]-N-[(4-fluorophenyl)methyl]-N-[(3-methyl-2-thiophenyl)methyl]acetamide
IUPAC NAME: 2-[(2-chloroacetyl)-propan-2-ylamino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]acetamide
SYSTEMATIC NAME: 2-[2-chloranylethanoyl(propan-2-yl)amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]ethanamide
MOLECULAR FORMULA: C20H24ClFN2O2S
MOLECULAR WEIGHT: 410.933163
SMILES: CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)CN(C(C)C)C(=O)CCl
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Product OPENEYE NAME: 3,5-dichloro-N-[2-[(4-fluorophenyl)methyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide
CAS Name: 3,5-dichloro-N-[2-[(4-fluorophenyl)methyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]-N-(2-oxolanylmethyl)benzamide
IUPAC NAME: 3,5-dichloro-N-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-(oxolan-2-ylmethyl)benzamide
SYSTEMATIC NAME: 3,5-bis(chloranyl)-N-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(oxolan-2-ylmethyl)benzamide
MOLECULAR FORMULA: C27H27Cl2FN2O3S
MOLECULAR WEIGHT: 549.484283
SMILES: CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)CN(CC3CCCO3)C(=O)C4=CC(=CC(=C4)Cl)Cl
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-fluorophenyl)carbamoyl-isobutyl-amino]-N-(2-thienylmethyl)acetamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[(2-fluoroanilino)-oxomethyl]-(2-methylpropyl)amino]-N-(thiophen-2-ylmethyl)acetamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-fluorophenyl)carbamoyl-(2-methylpropyl)amino]-N-(thiophen-2-ylmethyl)acetamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-fluorophenyl)carbamoyl-(2-methylpropyl)amino]-N-(thiophen-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C26H28FN3O4S
MOLECULAR WEIGHT: 497.581623
SMILES: CC(C)CN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)NC4=CC=CC=C4F
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Product OPENEYE NAME: N-[(4-fluorophenyl)methyl]-2-[(2-methoxyphenyl)carbamoyl-(3-methoxypropyl)amino]-N-(2-thienylmethyl)acetamide
CAS Name: N-[(4-fluorophenyl)methyl]-2-[[(2-methoxyanilino)-oxomethyl]-(3-methoxypropyl)amino]-N-(thiophen-2-ylmethyl)acetamide
IUPAC NAME: N-[(4-fluorophenyl)methyl]-2-[(2-methoxyphenyl)carbamoyl-(3-methoxypropyl)amino]-N-(thiophen-2-ylmethyl)acetamide
SYSTEMATIC NAME: N-[(4-fluorophenyl)methyl]-2-[(2-methoxyphenyl)carbamoyl-(3-methoxypropyl)amino]-N-(thiophen-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C26H30FN3O4S
MOLECULAR WEIGHT: 499.597503
SMILES: COCCCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=CC=CS2)C(=O)NC3=CC=CC=C3OC
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[(7,7-dimethyl-2-oxo-norbornan-1-yl)methylsulfonyl-(tetrahydrofuran-2-ylmethyl)amino]-N-(2-thienylmethyl)acetamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methylsulfonyl-(2-oxolanylmethyl)amino]-N-(thiophen-2-ylmethyl)acetamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methylsulfonyl-(oxolan-2-ylmethyl)amino]-N-(thiophen-2-ylmethyl)acetamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[(7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)methylsulfonyl-(oxolan-2-ylmethyl)amino]-N-(thiophen-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C30H38N2O7S2
MOLECULAR WEIGHT: 602.76192
SMILES: CC1(C2CCC1(C(=O)C2)CS(=O)(=O)N(CC3CCCO3)CC(=O)N(CC4=CC5=C(C=C4)OCO5)CC6=CC=CS6)C
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Product OPENEYE NAME: 2-(4-fluorophenoxy)-5-(4-fluorophenyl)pyrimidine
CAS Name: 2-(4-fluorophenoxy)-5-(4-fluorophenyl)pyrimidine
IUPAC NAME: 2-(4-fluorophenoxy)-5-(4-fluorophenyl)pyrimidine
SYSTEMATIC NAME: 2-(4-fluoranylphenoxy)-5-(4-fluorophenyl)pyrimidine
MOLECULAR FORMULA: C16H10F2N2O
MOLECULAR WEIGHT: 284.260206
SMILES: C1=CC(=CC=C1C2=CN=C(N=C2)OC3=CC=C(C=C3)F)F
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Product OPENEYE NAME: (4-methylpiperazin-1-yl)-[6-[1-(p-tolyl)pyrazol-4-yl]-3-pyridyl]methanone
CAS Name: [6-[1-(4-methylphenyl)-4-pyrazolyl]-3-pyridinyl]-(4-methyl-1-piperazinyl)methanone
IUPAC NAME: [6-[1-(4-methylphenyl)pyrazol-4-yl]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone
SYSTEMATIC NAME: [6-[1-(4-methylphenyl)pyrazol-4-yl]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone
MOLECULAR FORMULA: C21H23N5O
MOLECULAR WEIGHT: 361.44022
SMILES: CC1=CC=C(C=C1)N2C=C(C=N2)C3=NC=C(C=C3)C(=O)N4CCN(CC4)C
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Product OPENEYE NAME: N-(2-furylmethyl)-2,6-bis(4-pyridyl)pyrimidin-4-amine
CAS Name: N-(2-furanylmethyl)-2,6-dipyridin-4-yl-4-pyrimidinamine
IUPAC NAME: N-(furan-2-ylmethyl)-2,6-dipyridin-4-ylpyrimidin-4-amine
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-2,6-dipyridin-4-yl-pyrimidin-4-amine
MOLECULAR FORMULA: C19H15N5O
MOLECULAR WEIGHT: 329.3553
SMILES: C1=COC(=C1)CNC2=NC(=NC(=C2)C3=CC=NC=C3)C4=CC=NC=C4
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Thursday, January 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-[2-(2-ethoxy-2-oxo-ethylidene)-4-oxo-thiazolidin-5-ylidene]acetic acid
CAS Name: 2-[2-(2-ethoxy-2-oxoethylidene)-4-oxo-5-thiazolidinylidene]acetic acid
IUPAC NAME: 2-[2-(2-ethoxy-2-oxoethylidene)-4-oxo-1,3-thiazolidin-5-ylidene]acetic acid
SYSTEMATIC NAME: 2-[2-(2-ethoxy-2-oxidanylidene-ethylidene)-4-oxidanylidene-1,3-thiazolidin-5-ylidene]ethanoic acid
MOLECULAR FORMULA: C9H9NO5S
MOLECULAR WEIGHT: 243.23646
SMILES: CCOC(=O)C=C1NC(=O)C(=CC(=O)O)S1
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Product OPENEYE NAME: 5-[(4-allyloxy-3-chloro-5-ethoxy-phenyl)methylene]thiazolidine-2,4-dione
CAS Name: 5-[(3-chloro-5-ethoxy-4-prop-2-enoxyphenyl)methylidene]thiazolidine-2,4-dione
IUPAC NAME: 5-[(3-chloro-5-ethoxy-4-prop-2-enoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[(3-chloranyl-5-ethoxy-4-prop-2-enoxy-phenyl)methylidene]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C15H14ClNO4S
MOLECULAR WEIGHT: 339.79396
SMILES: CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)S2)Cl)OCC=C
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Product OPENEYE NAME: methyl 2-[5-amino-6-cyano-7-(3-methoxyphenyl)-8-(methylcarbamoyl)-3-oxo-7H-thiazolo[3,2-a]pyridin-2-yl]acetate
CAS Name: 2-[5-amino-6-cyano-7-(3-methoxyphenyl)-8-(methylcarbamoyl)-3-oxo-7H-thiazolo[3,2-a]pyridin-2-yl]acetic acid methyl ester
IUPAC NAME: methyl 2-[5-amino-6-cyano-7-(3-methoxyphenyl)-8-(methylcarbamoyl)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridin-2-yl]acetate
SYSTEMATIC NAME: methyl 2-[5-azanyl-6-cyano-7-(3-methoxyphenyl)-8-(methylcarbamoyl)-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridin-2-yl]ethanoate
MOLECULAR FORMULA: C20H20N4O5S
MOLECULAR WEIGHT: 428.4616
SMILES: CNC(=O)C1=C2N(C(=O)C(S2)CC(=O)OC)C(=C(C1C3=CC(=CC=C3)OC)C#N)N
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Product OPENEYE NAME: 2-[[2-(benzotriazol-1-yl)acetyl]-(o-tolylmethyl)amino]-2-(3,4-dimethoxyphenyl)-N-(4-morpholinophenyl)acetamide
CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-[(2-methylphenyl)methyl]amino]-2-(3,4-dimethoxyphenyl)-N-[4-(4-morpholinyl)phenyl]acetamide
IUPAC NAME: 2-[[2-(benzotriazol-1-yl)acetyl]-[(2-methylphenyl)methyl]amino]-2-(3,4-dimethoxyphenyl)-N-(4-morpholin-4-ylphenyl)acetamide
SYSTEMATIC NAME: 2-[2-(benzotriazol-1-yl)ethanoyl-[(2-methylphenyl)methyl]amino]-2-(3,4-dimethoxyphenyl)-N-(4-morpholin-4-ylphenyl)ethanamide
MOLECULAR FORMULA: C36H38N6O5
MOLECULAR WEIGHT: 634.72412
SMILES: CC1=CC=CC=C1CN(C(C2=CC(=C(C=C2)OC)OC)C(=O)NC3=CC=C(C=C3)N4CCOCC4)C(=O)CN5C6=CC=CC=C6N=N5
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Product OPENEYE NAME: N-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethyl]-4-fluoro-benzamide
CAS Name: N-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethyl]-4-fluorobenzamide
IUPAC NAME: N-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethyl]-4-fluorobenzamide
SYSTEMATIC NAME: N-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethyl]-4-fluoranyl-benzamide
MOLECULAR FORMULA: C23H25FN2O
MOLECULAR WEIGHT: 364.455803
SMILES: CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CCNC(=O)C4=CC=C(C=C4)F
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Product OPENEYE NAME: 3-(3-fluorophenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(2-pyridylmethyl)thiourea
CAS Name: 3-(3-fluorophenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(2-pyridinylmethyl)thiourea
IUPAC NAME: 3-(3-fluorophenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-2-ylmethyl)thiourea
SYSTEMATIC NAME: 3-(3-fluorophenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-2-ylmethyl)thiourea
MOLECULAR FORMULA: C24H23FN4S
MOLECULAR WEIGHT: 418.529623
SMILES: CC1=C(C2=CC=CC=C2N1)CCN(CC3=CC=CC=N3)C(=S)NC4=CC(=CC=C4)F
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Product OPENEYE NAME: N-(2-methyl-4-nitro-phenyl)-5-oxo-thiazolo[3,2-a]pyrimidine-6-carboxamide
CAS Name: N-(2-methyl-4-nitrophenyl)-5-oxo-6-thiazolo[3,2-a]pyrimidinecarboxamide
IUPAC NAME: N-(2-methyl-4-nitrophenyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SYSTEMATIC NAME: N-(2-methyl-4-nitro-phenyl)-5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
MOLECULAR FORMULA: C14H10N4O4S
MOLECULAR WEIGHT: 330.3186
SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=CN=C3N(C2=O)C=CS3
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Product OPENEYE NAME: ethyl 5-[(2,4-dichlorobenzoyl)amino]-4-oxo-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylate
CAS Name: 5-[[(2,4-dichlorophenyl)-oxomethyl]amino]-3-(4-methylphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 5-[(2,4-dichlorobenzoyl)amino]-3-(4-methylphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate
SYSTEMATIC NAME: ethyl 5-[(2,4-dichlorophenyl)carbonylamino]-3-(4-methylphenyl)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate
MOLECULAR FORMULA: C23H17Cl2N3O4S
MOLECULAR WEIGHT: 502.36978
SMILES: CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)C
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Product OPENEYE NAME: 3,4,5-trimethoxy-N-[(2-oxopyrrolidin-1-yl)methyl]-N-phenyl-benzamide
CAS Name: 3,4,5-trimethoxy-N-[(2-oxo-1-pyrrolidinyl)methyl]-N-phenylbenzamide
IUPAC NAME: 3,4,5-trimethoxy-N-[(2-oxopyrrolidin-1-yl)methyl]-N-phenylbenzamide
SYSTEMATIC NAME: 3,4,5-trimethoxy-N-[(2-oxidanylidenepyrrolidin-1-yl)methyl]-N-phenyl-benzamide
MOLECULAR FORMULA: C21H24N2O5
MOLECULAR WEIGHT: 384.42566
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)N(CN2CCCC2=O)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl 4-[(2-oxopyrrolidin-1-yl)methyl-[4-(trifluoromethyl)benzoyl]amino]benzoate
CAS Name: 4-[(2-oxo-1-pyrrolidinyl)methyl-[oxo-[4-(trifluoromethyl)phenyl]methyl]amino]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-[(2-oxopyrrolidin-1-yl)methyl-[4-(trifluoromethyl)benzoyl]amino]benzoate
SYSTEMATIC NAME: ethyl 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl-[4-(trifluoromethyl)phenyl]carbonyl-amino]benzoate
MOLECULAR FORMULA: C22H21F3N2O4
MOLECULAR WEIGHT: 434.40835
SMILES: CCOC(=O)C1=CC=C(C=C1)N(CN2CCCC2=O)C(=O)C3=CC=C(C=C3)C(F)(F)F
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Product OPENEYE NAME: 3-amino-N-(2-hydroxyethyl)-5-phenyl-pyrazine-2-carboxamide
CAS Name: 3-amino-N-(2-hydroxyethyl)-5-phenyl-2-pyrazinecarboxamide
IUPAC NAME: 3-amino-N-(2-hydroxyethyl)-5-phenylpyrazine-2-carboxamide
SYSTEMATIC NAME: 3-azanyl-N-(2-hydroxyethyl)-5-phenyl-pyrazine-2-carboxamide
MOLECULAR FORMULA: C13H14N4O2
MOLECULAR WEIGHT: 258.27586
SMILES: C1=CC=C(C=C1)C2=CN=C(C(=N2)N)C(=O)NCCO
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Product OPENEYE NAME: 2-(4-tert-butylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
CAS Name: 2-(4-tert-butylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
IUPAC NAME: 2-(4-tert-butylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
SYSTEMATIC NAME: 2-(4-tert-butylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
MOLECULAR FORMULA: C21H24N2O4S2
MOLECULAR WEIGHT: 432.55626
SMILES: CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)OC3=CC=C(C=C3)C(C)(C)C
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Product OPENEYE NAME: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-3,5-dinitro-benzamide
CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-3,5-dinitrobenzamide
IUPAC NAME: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-3,5-dinitrobenzamide
SYSTEMATIC NAME: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3,5-dinitro-benzamide
MOLECULAR FORMULA: C17H11ClFN5O5
MOLECULAR WEIGHT: 419.751143
SMILES: C1=CC(=C(C(=C1)Cl)CN2C=CC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])F
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Product OPENEYE NAME: 2-(1-adamantyl)-N-[3,5-dimethyl-1-(1-naphthylmethyl)pyrazol-4-yl]acetamide
CAS Name: 2-(1-adamantyl)-N-[3,5-dimethyl-1-(1-naphthalenylmethyl)-4-pyrazolyl]acetamide
IUPAC NAME: 2-(1-adamantyl)-N-[3,5-dimethyl-1-(naphthalen-1-ylmethyl)pyrazol-4-yl]acetamide
SYSTEMATIC NAME: 2-(1-adamantyl)-N-[3,5-dimethyl-1-(naphthalen-1-ylmethyl)pyrazol-4-yl]ethanamide
MOLECULAR FORMULA: C28H33N3O
MOLECULAR WEIGHT: 427.58112
SMILES: CC1=C(C(=NN1CC2=CC=CC3=CC=CC=C32)C)NC(=O)CC45CC6CC(C4)CC(C6)C5
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Product OPENEYE NAME: N-(1-adamantyl)-4-bromo-2-methyl-pyrazole-3-carboxamide
CAS Name: N-(1-adamantyl)-4-bromo-2-methyl-3-pyrazolecarboxamide
IUPAC NAME: N-(1-adamantyl)-4-bromo-2-methylpyrazole-3-carboxamide
SYSTEMATIC NAME: N-(1-adamantyl)-4-bromanyl-2-methyl-pyrazole-3-carboxamide
MOLECULAR FORMULA: C15H20BrN3O
MOLECULAR WEIGHT: 338.2428
SMILES: CN1C(=C(C=N1)Br)C(=O)NC23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: [7-(difluoromethyl)-5-(p-tolyl)pyrazolo[1,5-a]pyrimidin-3-yl]-morpholino-methanone
CAS Name: [7-(difluoromethyl)-5-(4-methylphenyl)-3-pyrazolo[1,5-a]pyrimidinyl]-(4-morpholinyl)methanone
IUPAC NAME: [7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]-morpholin-4-ylmethanone
SYSTEMATIC NAME: [7-[bis(fluoranyl)methyl]-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]-morpholin-4-yl-methanone
MOLECULAR FORMULA: C19H18F2N4O2
MOLECULAR WEIGHT: 372.368626
SMILES: CC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)N4CCOCC4
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Product OPENEYE NAME: 7-(2-methoxyphenyl)-5-phenyl-4-propylsulfanyl-pyrrolo[2,3-d]pyrimidine
CAS Name: 7-(2-methoxyphenyl)-5-phenyl-4-(propylthio)pyrrolo[2,3-d]pyrimidine
IUPAC NAME: 7-(2-methoxyphenyl)-5-phenyl-4-propylsulfanylpyrrolo[2,3-d]pyrimidine
SYSTEMATIC NAME: 7-(2-methoxyphenyl)-5-phenyl-4-propylsulfanyl-pyrrolo[2,3-d]pyrimidine
MOLECULAR FORMULA: C22H21N3OS
MOLECULAR WEIGHT: 375.48664
SMILES: CCCSC1=NC=NC2=C1C(=CN2C3=CC=CC=C3OC)C4=CC=CC=C4
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Product OPENEYE NAME: 2-methoxy-N-[2-[3-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanylindol-1-yl]ethyl]benzamide
CAS Name: 2-methoxy-N-[2-[3-[[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]thio]-1-indolyl]ethyl]benzamide
IUPAC NAME: 2-methoxy-N-[2-[3-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanylindol-1-yl]ethyl]benzamide
SYSTEMATIC NAME: 2-methoxy-N-[2-[3-[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]sulfanylindol-1-yl]ethyl]benzamide
MOLECULAR FORMULA: C27H24F3N3O3S
MOLECULAR WEIGHT: 527.55797
SMILES: COC1=CC=CC=C1C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC=CC=C4C(F)(F)F
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Product OPENEYE NAME: N-[2-[3-(2-morpholino-2-oxo-ethyl)sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide
CAS Name: N-[2-[3-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1-indolyl]ethyl]-2-thiophenecarboxamide
IUPAC NAME: N-[2-[3-(2-morpholin-4-yl-2-oxoethyl)sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[2-[3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C21H23N3O3S2
MOLECULAR WEIGHT: 429.55562
SMILES: C1COCCN1C(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CS4
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All Chemical Compounds Information




Product OPENEYE NAME: 5-(1-naphthylmethylene)-2-phenyl-1H-imidazol-4-one
CAS Name: 5-(1-naphthalenylmethylidene)-2-phenyl-1H-imidazol-4-one
IUPAC NAME: 5-(naphthalen-1-ylmethylidene)-2-phenyl-1H-imidazol-4-one
SYSTEMATIC NAME: 5-(naphthalen-1-ylmethylidene)-2-phenyl-1H-imidazol-4-one
MOLECULAR FORMULA: C20H14N2O
MOLECULAR WEIGHT: 298.33796
SMILES: C1=CC=C(C=C1)C2=NC(=O)C(=CC3=CC=CC4=CC=CC=C43)N2
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Product OPENEYE NAME: 5-(m-tolylmethylene)-2-phenyl-1H-imidazol-4-one
CAS Name: 5-[(3-methylphenyl)methylidene]-2-phenyl-1H-imidazol-4-one
IUPAC NAME: 5-[(3-methylphenyl)methylidene]-2-phenyl-1H-imidazol-4-one
SYSTEMATIC NAME: 5-[(3-methylphenyl)methylidene]-2-phenyl-1H-imidazol-4-one
MOLECULAR FORMULA: C17H14N2O
MOLECULAR WEIGHT: 262.30586
SMILES: CC1=CC=CC(=C1)C=C2C(=O)N=C(N2)C3=CC=CC=C3
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Product OPENEYE NAME: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzonitrile
CAS Name: 4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzonitrile
IUPAC NAME: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzonitrile
SYSTEMATIC NAME: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzenecarbonitrile
MOLECULAR FORMULA: C14H13N3S
MOLECULAR WEIGHT: 255.33812
SMILES: CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C#N)C
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Product OPENEYE NAME: 2-[4-[4-(dimethylamino)phenyl]azophenyl]-6-(4-hydroxy-3-methyl-phenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
CAS Name: 2-[4-[4-(dimethylamino)phenyl]azophenyl]-6-(4-hydroxy-3-methylphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
IUPAC NAME: 2-[4-[[4-(dimethylamino)phenyl]diazenyl]phenyl]-6-(4-hydroxy-3-methylphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
SYSTEMATIC NAME: 2-[4-[[4-(dimethylamino)phenyl]diazenyl]phenyl]-6-(3-methyl-4-oxidanyl-phenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
MOLECULAR FORMULA: C49H42N4O5
MOLECULAR WEIGHT: 766.88158
SMILES: CC1=C(C=CC(=C1)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)C8=CC=C(C=C8)N=NC9=CC=C(C=C9)N(C)C)O
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Product OPENEYE NAME: 6-(4-hydroxy-3-methyl-phenyl)-2-(4-morpholinophenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
CAS Name: 6-(4-hydroxy-3-methylphenyl)-2-[4-(4-morpholinyl)phenyl]-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
IUPAC NAME: 6-(4-hydroxy-3-methylphenyl)-2-(4-morpholin-4-ylphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
SYSTEMATIC NAME: 6-(3-methyl-4-oxidanyl-phenyl)-2-(4-morpholin-4-ylphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
MOLECULAR FORMULA: C45H40N2O6
MOLECULAR WEIGHT: 704.8089
SMILES: CC1=C(C=CC(=C1)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)C8=CC=C(C=C8)N9CCOCC9)O
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Product OPENEYE NAME: [3-[6-(4-hydroxy-3-methyl-phenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]phenyl]boronic acid
CAS Name: [3-[6-(4-hydroxy-3-methylphenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]phenyl]boronic acid
IUPAC NAME: [3-[6-(4-hydroxy-3-methylphenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]phenyl]boronic acid
SYSTEMATIC NAME: [3-[6-(3-methyl-4-oxidanyl-phenyl)-1,3,7,10-tetrakis(oxidanylidene)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]phenyl]boronic acid
MOLECULAR FORMULA: C41H34BNO7
MOLECULAR WEIGHT: 663.52216
SMILES: B(C1=CC(=CC=C1)N2C(=O)C3CC=C4C(C3C2=O)CC5C(=O)C(=CC(=O)C5(C4C6=CC(=C(C=C6)O)C)C7=CC=CC=C7)C8=CC=CC=C8)(O)O
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Product OPENEYE NAME: 3-[6-(4-hydroxy-3-methyl-phenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]benzoic acid
CAS Name: 3-[6-(4-hydroxy-3-methylphenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]benzoic acid
IUPAC NAME: 3-[6-(4-hydroxy-3-methylphenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]benzoic acid
SYSTEMATIC NAME: 3-[6-(3-methyl-4-oxidanyl-phenyl)-1,3,7,10-tetrakis(oxidanylidene)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]benzoic acid
MOLECULAR FORMULA: C42H33NO7
MOLECULAR WEIGHT: 663.71392
SMILES: CC1=C(C=CC(=C1)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)C8=CC=CC(=C8)C(=O)O)O
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Product OPENEYE NAME: 2-hydroxy-4-[6-(4-hydroxy-3-methyl-phenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]benzoic acid
CAS Name: 2-hydroxy-4-[6-(4-hydroxy-3-methylphenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]benzoic acid
IUPAC NAME: 2-hydroxy-4-[6-(4-hydroxy-3-methylphenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]benzoic acid
SYSTEMATIC NAME: 4-[6-(3-methyl-4-oxidanyl-phenyl)-1,3,7,10-tetrakis(oxidanylidene)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindol-2-yl]-2-oxidanyl-benzoic acid
MOLECULAR FORMULA: C42H33NO8
MOLECULAR WEIGHT: 679.71332
SMILES: CC1=C(C=CC(=C1)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)C8=CC(=C(C=C8)C(=O)O)O)O
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Product OPENEYE NAME: 6-(4-hydroxy-3,5-dimethyl-phenyl)-2-methyl-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
CAS Name: 6-(4-hydroxy-3,5-dimethylphenyl)-2-methyl-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
IUPAC NAME: 6-(4-hydroxy-3,5-dimethylphenyl)-2-methyl-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
SYSTEMATIC NAME: 6-(3,5-dimethyl-4-oxidanyl-phenyl)-2-methyl-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
MOLECULAR FORMULA: C37H33NO5
MOLECULAR WEIGHT: 571.66162
SMILES: CC1=CC(=CC(=C1O)C)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)C
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Product OPENEYE NAME: 2-ethyl-6-(4-hydroxy-3,5-dimethyl-phenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
CAS Name: 2-ethyl-6-(4-hydroxy-3,5-dimethylphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
IUPAC NAME: 2-ethyl-6-(4-hydroxy-3,5-dimethylphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
SYSTEMATIC NAME: 6-(3,5-dimethyl-4-oxidanyl-phenyl)-2-ethyl-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
MOLECULAR FORMULA: C38H35NO5
MOLECULAR WEIGHT: 585.6882
SMILES: CCN1C(=O)C2CC=C3C(C2C1=O)CC4C(=O)C(=CC(=O)C4(C3C5=CC(=C(C(=C5)C)O)C)C6=CC=CC=C6)C7=CC=CC=C7
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Product OPENEYE NAME: 6-(4-hydroxy-3,5-dimethyl-phenyl)-6a,9-diphenyl-2-propyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
CAS Name: 6-(4-hydroxy-3,5-dimethylphenyl)-6a,9-diphenyl-2-propyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
IUPAC NAME: 6-(4-hydroxy-3,5-dimethylphenyl)-6a,9-diphenyl-2-propyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
SYSTEMATIC NAME: 6-(3,5-dimethyl-4-oxidanyl-phenyl)-6a,9-diphenyl-2-propyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
MOLECULAR FORMULA: C39H37NO5
MOLECULAR WEIGHT: 599.71478
SMILES: CCCN1C(=O)C2CC=C3C(C2C1=O)CC4C(=O)C(=CC(=O)C4(C3C5=CC(=C(C(=C5)C)O)C)C6=CC=CC=C6)C7=CC=CC=C7
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Product OPENEYE NAME: 2-benzyl-6-(4-hydroxy-3,5-dimethyl-phenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
CAS Name: 6-(4-hydroxy-3,5-dimethylphenyl)-6a,9-diphenyl-2-(phenylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
IUPAC NAME: 2-benzyl-6-(4-hydroxy-3,5-dimethylphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
SYSTEMATIC NAME: 6-(3,5-dimethyl-4-oxidanyl-phenyl)-6a,9-diphenyl-2-(phenylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
MOLECULAR FORMULA: C43H37NO5
MOLECULAR WEIGHT: 647.75758
SMILES: CC1=CC(=CC(=C1O)C)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)CC8=CC=CC=C8
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Product OPENEYE NAME: 6-(4-hydroxy-3,5-dimethyl-phenyl)-6a,9-diphenyl-2-(2-thienylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
CAS Name: 6-(4-hydroxy-3,5-dimethylphenyl)-6a,9-diphenyl-2-(thiophen-2-ylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
IUPAC NAME: 6-(4-hydroxy-3,5-dimethylphenyl)-6a,9-diphenyl-2-(thiophen-2-ylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
SYSTEMATIC NAME: 6-(3,5-dimethyl-4-oxidanyl-phenyl)-6a,9-diphenyl-2-(thiophen-2-ylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone
MOLECULAR FORMULA: C41H35NO5S
MOLECULAR WEIGHT: 653.7853
SMILES: CC1=CC(=CC(=C1O)C)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)CC8=CC=CS8
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Product OPENEYE NAME: 1,1,2-triphenyl-2-(2-piperidyl)ethanol
CAS Name: 1,1,2-triphenyl-2-(2-piperidinyl)ethanol
IUPAC NAME: 1,1,2-triphenyl-2-piperidin-2-ylethanol
SYSTEMATIC NAME: 1,1,2-triphenyl-2-piperidin-2-yl-ethanol
MOLECULAR FORMULA: C25H27NO
MOLECULAR WEIGHT: 357.48798
SMILES: C1CCNC(C1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O
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Product OPENEYE NAME: trimethyl-[2-[4-(trifluoromethyl)phenyl]ethynyl]silane
CAS Name: trimethyl-[2-[4-(trifluoromethyl)phenyl]ethynyl]silane
IUPAC NAME: trimethyl-[2-[4-(trifluoromethyl)phenyl]ethynyl]silane
SYSTEMATIC NAME: trimethyl-[2-[4-(trifluoromethyl)phenyl]ethynyl]silane
MOLECULAR FORMULA: C12H13F3Si
MOLECULAR WEIGHT: 242.31233
SMILES: C[Si](C)(C)C#CC1=CC=C(C=C1)C(F)(F)F
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Product OPENEYE NAME: ethyl 4-[[6-[(2-fluorophenyl)carbamoyl]-3-[(4-methoxyphenyl)methyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate
CAS Name: 4-[[6-[(2-fluoroanilino)-oxomethyl]-3-[(4-methoxyphenyl)methyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-[[6-[(2-fluorophenyl)carbamoyl]-3-[(4-methoxyphenyl)methyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate
SYSTEMATIC NAME: ethyl 4-[[6-[(2-fluorophenyl)carbamoyl]-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-1,3-thiazinan-2-ylidene]amino]benzoate
MOLECULAR FORMULA: C28H26FN3O5S
MOLECULAR WEIGHT: 535.586543
SMILES: CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=CC=C3F)CC4=CC=C(C=C4)OC
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Product OPENEYE NAME: ethyl 4-[[3-benzyl-6-[(4-hexoxyphenyl)carbamoyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate
CAS Name: 4-[[6-[(4-hexoxyanilino)-oxomethyl]-4-oxo-3-(phenylmethyl)-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-[[3-benzyl-6-[(4-hexoxyphenyl)carbamoyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate
SYSTEMATIC NAME: ethyl 4-[[6-[(4-hexoxyphenyl)carbamoyl]-4-oxidanylidene-3-(phenylmethyl)-1,3-thiazinan-2-ylidene]amino]benzoate
MOLECULAR FORMULA: C33H37N3O5S
MOLECULAR WEIGHT: 587.72898
SMILES: CCCCCCOC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=C(C=C3)C(=O)OCC)S2)CC4=CC=CC=C4
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Product OPENEYE NAME: 2,2-bis(p-tolyl)-N-(p-tolylmethyleneamino)cyclopropanecarboxamide
CAS Name: 2,2-bis(4-methylphenyl)-N-[(4-methylphenyl)methylideneamino]-1-cyclopropanecarboxamide
IUPAC NAME: 2,2-bis(4-methylphenyl)-N-[(4-methylphenyl)methylideneamino]cyclopropane-1-carboxamide
SYSTEMATIC NAME: 2,2-bis(4-methylphenyl)-N-[(4-methylphenyl)methylideneamino]cyclopropane-1-carboxamide
MOLECULAR FORMULA: C26H26N2O
MOLECULAR WEIGHT: 382.49744
SMILES: CC1=CC=C(C=C1)C=NNC(=O)C2CC2(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C
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Product OPENEYE NAME: [4-[(4-chlorophenyl)methylcarbamoyl]phenyl] acetate
CAS Name: acetic acid [4-[[(4-chlorophenyl)methylamino]-oxomethyl]phenyl] ester
IUPAC NAME: [4-[(4-chlorophenyl)methylcarbamoyl]phenyl] acetate
SYSTEMATIC NAME: [4-[(4-chlorophenyl)methylcarbamoyl]phenyl] ethanoate
MOLECULAR FORMULA: C16H14ClNO3
MOLECULAR WEIGHT: 303.74026
SMILES: CC(=O)OC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-N-(2-morpholinoethyl)nonanamide
CAS Name: N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-N-[2-(4-morpholinyl)ethyl]nonanamide
IUPAC NAME: N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-(2-morpholin-4-ylethyl)nonanamide
SYSTEMATIC NAME: N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(2-morpholin-4-ylethyl)nonanamide
MOLECULAR FORMULA: C21H36N4O4
MOLECULAR WEIGHT: 408.53494
SMILES: CCCCCCCCC(=O)N(CCN1CCOCC1)CC(=O)NC2=NOC(=C2)C
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Product OPENEYE NAME: N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methoxyphenyl)methyl]amino]-2-oxo-ethyl]-N-isobutyl-4-(trifluoromethyl)benzamide
CAS Name: N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-4-(trifluoromethyl)benzamide
IUPAC NAME: N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-4-(trifluoromethyl)benzamide
SYSTEMATIC NAME: N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methoxyphenyl)methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-4-(trifluoromethyl)benzamide
MOLECULAR FORMULA: C32H34F3N3O3
MOLECULAR WEIGHT: 565.62587
SMILES: CC(C)CN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=C(C=C3)OC)C(=O)C4=CC=C(C=C4)C(F)(F)F
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Product OPENEYE NAME: N-[2-[3-(3-chloro-2-methyl-phenyl)-4-oxo-imidazolidin-1-yl]-2-oxo-ethyl]-N-(2-methoxyethyl)pentanamide
CAS Name: N-[2-[3-(3-chloro-2-methylphenyl)-4-oxo-1-imidazolidinyl]-2-oxoethyl]-N-(2-methoxyethyl)pentanamide
IUPAC NAME: N-[2-[3-(3-chloro-2-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methoxyethyl)pentanamide
SYSTEMATIC NAME: N-[2-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-imidazolidin-1-yl]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)pentanamide
MOLECULAR FORMULA: C20H28ClN3O4
MOLECULAR WEIGHT: 409.90702
SMILES: CCCCC(=O)N(CCOC)CC(=O)N1CC(=O)N(C1)C2=C(C(=CC=C2)Cl)C
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Product OPENEYE NAME: 2-[[3-(4-bromophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CAS Name: 2-[[3-(4-bromophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
IUPAC NAME: 2-[[3-(4-bromophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
SYSTEMATIC NAME: 2-[[3-(4-bromophenyl)-4-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide
MOLECULAR FORMULA: C22H18BrN3O4S2
MOLECULAR WEIGHT: 532.43002
SMILES: C1CSC2=C1N=C(N(C2=O)C3=CC=C(C=C3)Br)SCC(=O)NC4=CC5=C(C=C4)OCCO5
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All Chemical Compounds Information




Product OPENEYE NAME: 2-(4-chlorophenyl)ethyl-[1-(4-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]ammonium
CAS Name: 2-(4-chlorophenyl)ethyl-[1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]ammonium
IUPAC NAME: 2-(4-chlorophenyl)ethyl-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]azanium
SYSTEMATIC NAME: 2-(4-chlorophenyl)ethyl-[1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium
MOLECULAR FORMULA: C19H20ClN2O3+
MOLECULAR WEIGHT: 359.8267
SMILES: COC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]CCC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [1-(4-chlorophenyl)-2,5-dioxo-pyrrolidin-3-yl]-[2-(4-chlorophenyl)ethyl]ammonium
CAS Name: [1-(4-chlorophenyl)-2,5-dioxo-3-pyrrolidinyl]-[2-(4-chlorophenyl)ethyl]ammonium
IUPAC NAME: [1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-[2-(4-chlorophenyl)ethyl]azanium
SYSTEMATIC NAME: [1-(4-chlorophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-[2-(4-chlorophenyl)ethyl]azanium
MOLECULAR FORMULA: C18H17Cl2N2O2+
MOLECULAR WEIGHT: 364.24578
SMILES: C1C(C(=O)N(C1=O)C2=CC=C(C=C2)Cl)[NH2+]CCC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[(3-chlorophenyl)-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-yl)methyl]propanedinitrile
CAS Name: 2-[(3-chlorophenyl)-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinyl)methyl]propanedinitrile
IUPAC NAME: 2-[(3-chlorophenyl)-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-yl)methyl]propanedinitrile
SYSTEMATIC NAME: 2-[(3-chlorophenyl)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-yl)methyl]propanedinitrile
MOLECULAR FORMULA: C20H15ClN4O
MOLECULAR WEIGHT: 362.8123
SMILES: C=C1C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC(=CC=C3)Cl)C(C#N)C#N
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Product OPENEYE NAME: 4-[5-[(2-methyl-1-naphthyl)methylsulfanyl]tetrazol-1-yl]benzoate
CAS Name: 4-[5-[(2-methyl-1-naphthalenyl)methylthio]-1-tetrazolyl]benzoate
IUPAC NAME: 4-[5-[(2-methylnaphthalen-1-yl)methylsulfanyl]tetrazol-1-yl]benzoate
SYSTEMATIC NAME: 4-[5-[(2-methylnaphthalen-1-yl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]benzoate
MOLECULAR FORMULA: C20H15N4O2S-
MOLECULAR WEIGHT: 375.4237
SMILES: CC1=C(C2=CC=CC=C2C=C1)CSC3=NN=NN3C4=CC=C(C=C4)C(=O)[O-]
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Product OPENEYE NAME: 4-[1,3-benzodioxol-5-yl-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
CAS Name: 4-[1,3-benzodioxol-5-yl-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinyl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
IUPAC NAME: 4-[1,3-benzodioxol-5-yl-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
SYSTEMATIC NAME: 4-[1,3-benzodioxol-5-yl-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
MOLECULAR FORMULA: C28H24N4O4
MOLECULAR WEIGHT: 480.51456
SMILES: CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3C(=C)NN(C3=O)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6
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Product OPENEYE NAME: 4-[1,3-benzodioxol-5-yl-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-yl)methyl]-5-methylene-2-phenyl-pyrazolidin-3-one
CAS Name: 4-[1,3-benzodioxol-5-yl-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinyl)methyl]-5-methylene-2-phenyl-3-pyrazolidinone
IUPAC NAME: 4-[1,3-benzodioxol-5-yl-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-yl)methyl]-5-methylidene-2-phenylpyrazolidin-3-one
SYSTEMATIC NAME: 4-[1,3-benzodioxol-5-yl-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-yl)methyl]-5-methylidene-2-phenyl-pyrazolidin-3-one
MOLECULAR FORMULA: C28H24N4O4
MOLECULAR WEIGHT: 480.51456
SMILES: C=C1C(C(=O)N(N1)C2=CC=CC=C2)C(C3C(=C)NN(C3=O)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6
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Product OPENEYE NAME: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[[4-(2-pyridyl)piperazin-1-ium-1-yl]methyl]triazole-4-carboxylate
CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[[4-(2-pyridinyl)-1-piperazin-1-iumyl]methyl]-4-triazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-pyridin-2-ylpiperazin-1-ium-1-yl)methyl]triazole-4-carboxylate
SYSTEMATIC NAME: ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[(4-pyridin-2-ylpiperazin-1-ium-1-yl)methyl]-1,2,3-triazole-4-carboxylate
MOLECULAR FORMULA: C17H22N9O3+
MOLECULAR WEIGHT: 400.41508
SMILES: CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)C[NH+]3CCN(CC3)C4=CC=CC=N4
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Product OPENEYE NAME: N-hexadecyl-1-methyl-pyrrolidine-2-carboxamide
CAS Name: N-hexadecyl-1-methyl-2-pyrrolidinecarboxamide
IUPAC NAME: N-hexadecyl-1-methylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: N-hexadecyl-1-methyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C22H44N2O
MOLECULAR WEIGHT: 352.59756
SMILES: CCCCCCCCCCCCCCCCNC(=O)C1CCCN1C
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Product OPENEYE NAME: 3-[(3-methyl-2-thienyl)methyleneamino]benzenesulfonamide
CAS Name: 3-[(3-methyl-2-thiophenyl)methylideneamino]benzenesulfonamide
IUPAC NAME: 3-[(3-methylthiophen-2-yl)methylideneamino]benzenesulfonamide
SYSTEMATIC NAME: 3-[(3-methylthiophen-2-yl)methylideneamino]benzenesulfonamide
MOLECULAR FORMULA: C12H12N2O2S2
MOLECULAR WEIGHT: 280.36588
SMILES: CC1=C(SC=C1)C=NC2=CC(=CC=C2)S(=O)(=O)N
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