Product OPENEYE NAME: N-(cyclododecylideneamino)-4-methyl-3-nitro-benzamide
CAS Name: N-(cyclododecylideneamino)-4-methyl-3-nitrobenzamide
IUPAC NAME: N-(cyclododecylideneamino)-4-methyl-3-nitrobenzamide
SYSTEMATIC NAME: N-(cyclododecylideneamino)-4-methyl-3-nitro-benzamide
MOLECULAR FORMULA: C20H29N3O3
MOLECULAR WEIGHT: 359.46256
SMILES: CC1=C(C=C(C=C1)C(=O)NN=C2CCCCCCCCCCC2)[N+](=O)[O-]
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Product OPENEYE NAME: 3-(2-chloro-6-fluoro-phenyl)-1-(2,6-dimethyl-1-piperidyl)prop-2-en-1-one
CAS Name: 3-(2-chloro-6-fluorophenyl)-1-(2,6-dimethyl-1-piperidinyl)-2-propen-1-one
IUPAC NAME: 3-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylpiperidin-1-yl)prop-2-en-1-one
SYSTEMATIC NAME: 3-(2-chloranyl-6-fluoranyl-phenyl)-1-(2,6-dimethylpiperidin-1-yl)prop-2-en-1-one
MOLECULAR FORMULA: C16H19ClFNO
MOLECULAR WEIGHT: 295.779563
SMILES: CC1CCCC(N1C(=O)C=CC2=C(C=CC=C2Cl)F)C
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Product OPENEYE NAME: methyl 6-tert-butyl-2-[[2-(4-chlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Name: 6-tert-butyl-2-[[[2-(4-chlorophenyl)-3-methyl-4-quinolinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester
IUPAC NAME: methyl 6-tert-butyl-2-[[2-(4-chlorophenyl)-3-methylquinoline-4-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SYSTEMATIC NAME: methyl 6-tert-butyl-2-[[2-(4-chlorophenyl)-3-methyl-quinolin-4-yl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
MOLECULAR FORMULA: C31H31ClN2O3S
MOLECULAR WEIGHT: 547.10744
SMILES: CC1=C(C2=CC=CC=C2N=C1C3=CC=C(C=C3)Cl)C(=O)NC4=C(C5=C(S4)CC(CC5)C(C)(C)C)C(=O)OC
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Product OPENEYE NAME: N-[1-(4-cyclohexylphenyl)ethylideneamino]-3-fluoro-benzamide
CAS Name: N-[1-(4-cyclohexylphenyl)ethylideneamino]-3-fluorobenzamide
IUPAC NAME: N-[1-(4-cyclohexylphenyl)ethylideneamino]-3-fluorobenzamide
SYSTEMATIC NAME: N-[1-(4-cyclohexylphenyl)ethylideneamino]-3-fluoranyl-benzamide
MOLECULAR FORMULA: C21H23FN2O
MOLECULAR WEIGHT: 338.418523
SMILES: CC(=NNC(=O)C1=CC(=CC=C1)F)C2=CC=C(C=C2)C3CCCCC3
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Product OPENEYE NAME: [2-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl-[1-(2-naphthyl)ethyl]amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-1-methyl-2-oxo-ethyl] acetate
CAS Name: acetic acid [1-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl-[1-(2-naphthalenyl)ethyl]amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [1-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl(1-naphthalen-2-ylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-1-oxopropan-2-yl] acetate
SYSTEMATIC NAME: [1-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[methyl(1-naphthalen-2-ylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-1-oxidanylidene-propan-2-yl] ethanoate
MOLECULAR FORMULA: C43H46N2O6
MOLECULAR WEIGHT: 686.83514
SMILES: CC(C1=CC2=CC=CC=C2C=C1)N(C)CC3CC(OC(O3)C4=CC=CC(=C4)C5=CC(=CC=C5)CNC(=O)C(C)OC(=O)C)C6=CC=C(C=C6)CO
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Product OPENEYE NAME: 5-[[3-[4-[4-[[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-5-oxo-pentanoic acid
CAS Name: 5-[[3-[4-[4-[[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-5-oxopentanoic acid
IUPAC NAME: 5-[[3-[4-[4-[[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[3-[4-[4-[[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C41H45ClN2O7
MOLECULAR WEIGHT: 713.2582
SMILES: C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CC3CC(OC(O3)C4=CC=C(C=C4)C5=CC(=CC=C5)CNC(=O)CCCC(=O)O)C6=CC=C(C=C6)CO
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Product OPENEYE NAME: 5-[4-[4-[[allyl(methyl)amino]methyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]anilino]-5-oxo-pentanoic acid
CAS Name: 5-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(prop-2-enyl)amino]methyl]-1,3-dioxan-2-yl]anilino]-5-oxopentanoic acid
IUPAC NAME: 5-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(prop-2-enyl)amino]methyl]-1,3-dioxan-2-yl]anilino]-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(prop-2-enyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C28H36N2O6
MOLECULAR WEIGHT: 496.59524
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)NC(=O)CCCC(=O)O)CN(C)CC=C
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Product OPENEYE NAME: 4-[[6-[4-(hydroxymethyl)phenyl]-5-methyl-2-[4-[[3-phenyl-2-(p-tolylsulfonylamino)propanoyl]amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
CAS Name: 4-[[6-[4-(hydroxymethyl)phenyl]-5-methyl-2-[4-[[2-[(4-methylphenyl)sulfonylamino]-1-oxo-3-phenylpropyl]amino]phenyl]-1,3-dioxan-4-yl]methylthio]benzoic acid
IUPAC NAME: 4-[[6-[4-(hydroxymethyl)phenyl]-5-methyl-2-[4-[[2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoyl]amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
SYSTEMATIC NAME: 4-[[6-[4-(hydroxymethyl)phenyl]-5-methyl-2-[4-[[2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoyl]amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
MOLECULAR FORMULA: C42H42N2O8S2
MOLECULAR WEIGHT: 766.92148
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)NC(=O)C(CC4=CC=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C)CSC6=CC=C(C=C6)C(=O)O
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Product OPENEYE NAME: N-[4-[4-[4-(hydroxymethyl)phenyl]-6-(phenylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxamide
CAS Name: N-[4-[4-[4-(hydroxymethyl)phenyl]-6-[(phenylthio)methyl]-1,3-dioxan-2-yl]phenyl]-1-(2,2,2-trifluoro-1-oxoethyl)-2-pyrrolidinecarboxamide
IUPAC NAME: N-[4-[4-[4-(hydroxymethyl)phenyl]-6-(phenylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: N-[4-[4-[4-(hydroxymethyl)phenyl]-6-(phenylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]-1-[2,2,2-tris(fluoranyl)ethanoyl]pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C31H31F3N2O5S
MOLECULAR WEIGHT: 600.64845
SMILES: C1CC(N(C1)C(=O)C(F)(F)F)C(=O)NC2=CC=C(C=C2)C3OC(CC(O3)C4=CC=C(C=C4)CO)CSC5=CC=CC=C5
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Product OPENEYE NAME: [2-[4-[4-[(4-benzylpiperazin-1-yl)methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]anilino]-1-methyl-2-oxo-ethyl] acetate
CAS Name: acetic acid [1-[4-[4-[4-(hydroxymethyl)phenyl]-6-[[4-(phenylmethyl)-1-piperazinyl]methyl]-1,3-dioxan-2-yl]anilino]-1-oxopropan-2-yl] ester
IUPAC NAME: [1-[4-[4-[(4-benzylpiperazin-1-yl)methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]anilino]-1-oxopropan-2-yl] acetate
SYSTEMATIC NAME: [1-[[4-[4-[4-(hydroxymethyl)phenyl]-6-[[4-(phenylmethyl)piperazin-1-yl]methyl]-1,3-dioxan-2-yl]phenyl]amino]-1-oxidanylidene-propan-2-yl] ethanoate
MOLECULAR FORMULA: C34H41N3O6
MOLECULAR WEIGHT: 587.70584
SMILES: CC(C(=O)NC1=CC=C(C=C1)C2OC(CC(O2)C3=CC=C(C=C3)CO)CN4CCN(CC4)CC5=CC=CC=C5)OC(=O)C
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Product OPENEYE NAME: 3-[2-[5-bromo-6-hydroxy-6-[3-[2-(2-hydroxyethoxy)ethoxy]propyl]-3-oxo-pyran-2-yl]propanoyl]-4-isopropyl-5,5-dimethyl-oxazolidin-2-one
CAS Name: 3-[2-[5-bromo-6-hydroxy-6-[3-[2-(2-hydroxyethoxy)ethoxy]propyl]-3-oxo-2-pyranyl]-1-oxopropyl]-5,5-dimethyl-4-propan-2-yl-2-oxazolidinone
IUPAC NAME: 3-[2-[5-bromo-6-hydroxy-6-[3-[2-(2-hydroxyethoxy)ethoxy]propyl]-3-oxopyran-2-yl]propanoyl]-5,5-dimethyl-4-propan-2-yl-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3-[2-[5-bromanyl-6-[3-[2-(2-hydroxyethyloxy)ethoxy]propyl]-6-oxidanyl-3-oxidanylidene-pyran-2-yl]propanoyl]-5,5-dimethyl-4-propan-2-yl-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C23H36BrNO9
MOLECULAR WEIGHT: 550.43724
SMILES: CC(C)C1C(OC(=O)N1C(=O)C(C)C2C(=O)C=C(C(O2)(CCCOCCOCCO)O)Br)(C)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C52H72N2O8
MOLECULAR WEIGHT: 853.13668
SMILES: CCCCCC1(OC2C=C(CC(C2O1)OC(=O)C3=CC=C(C=C3)C=C4CCC5C(O5)(CCC6C4CC6(C)C)C)C(=O)N(C)C(CC7=CC=CC=C7)C(=O)NCCO)CCCCC
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Product OPENEYE NAME: [6-[2-(2-hydroxyethylcarbamoyl)pyrrolidine-1-carbonyl]-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-yl] 3-[3-(4,4-dimethyl-2-oxo-tetrahydrofuran-3-yl)oxy-3-oxo-prop-1-enyl]benzoate
CAS Name: 3-[3-[(4,4-dimethyl-2-oxo-3-oxolanyl)oxy]-3-oxoprop-1-enyl]benzoic acid [6-[[2-[(2-hydroxyethylamino)-oxomethyl]-1-pyrrolidinyl]-oxomethyl]-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-yl] ester
IUPAC NAME: [6-[2-(2-hydroxyethylcarbamoyl)pyrrolidine-1-carbonyl]-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-yl] 3-[3-(4,4-dimethyl-2-oxooxolan-3-yl)oxy-3-oxoprop-1-enyl]benzoate
SYSTEMATIC NAME: [6-[2-(2-hydroxyethylcarbamoyl)pyrrolidin-1-yl]carbonyl-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-yl] 3-[3-(4,4-dimethyl-2-oxidanylidene-oxolan-3-yl)oxy-3-oxidanylidene-prop-1-enyl]benzoate
MOLECULAR FORMULA: C31H36N2O11
MOLECULAR WEIGHT: 612.62434
SMILES: CC1(COC(=O)C1OC(=O)C=CC2=CC(=CC=C2)C(=O)OC3CC(=CC4C3OCO4)C(=O)N5CCCC5C(=O)NCCO)C
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Product OPENEYE NAME: N-(3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiophene-2-carboxamide
CAS Name: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-thiophenecarboxamide
IUPAC NAME: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiophene-2-carboxamide
SYSTEMATIC NAME: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiophene-2-carboxamide
MOLECULAR FORMULA: C15H14N2OS2
MOLECULAR WEIGHT: 302.41446
SMILES: CC1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CS3)C#N
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Product OPENEYE NAME: 4-bromo-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-fluoro-benzamide
CAS Name: 4-bromo-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-fluorobenzamide
IUPAC NAME: 4-bromo-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-fluorobenzamide
SYSTEMATIC NAME: 4-bromanyl-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-fluoranyl-benzamide
MOLECULAR FORMULA: C18H12BrFN2OS
MOLECULAR WEIGHT: 403.268083
SMILES: C1CC2=C(C3=CC=CC=C31)N=C(S2)NC(=O)C4=C(C=C(C=C4)Br)F
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Product OPENEYE NAME: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(2,5-dioxopyrrolidin-1-yl)benzamide
CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(2,5-dioxo-1-pyrrolidinyl)benzamide
IUPAC NAME: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(2,5-dioxopyrrolidin-1-yl)benzamide
SYSTEMATIC NAME: 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)benzamide
MOLECULAR FORMULA: C20H17N3O3S
MOLECULAR WEIGHT: 379.43228
SMILES: CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CC=C(C=C3)N4C(=O)CCC4=O)C
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Product OPENEYE NAME: N-[4-(2-oxochromen-3-yl)thiazol-2-yl]-2-phenoxy-benzamide
CAS Name: N-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-2-phenoxybenzamide
IUPAC NAME: N-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]-2-phenoxybenzamide
SYSTEMATIC NAME: N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]-2-phenoxy-benzamide
MOLECULAR FORMULA: C25H16N2O4S
MOLECULAR WEIGHT: 440.47054
SMILES: C1=CC=C(C=C1)OC2=CC=CC=C2C(=O)NC3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O
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Product OPENEYE NAME: [4-bromo-2-[[[2-(dodecanoylamino)acetyl]hydrazono]methyl]phenyl] 4-methylbenzoate
CAS Name: 4-methylbenzoic acid [4-bromo-2-[[[1-oxo-2-(1-oxododecylamino)ethyl]hydrazinylidene]methyl]phenyl] ester
IUPAC NAME: [4-bromo-2-[[[2-(dodecanoylamino)acetyl]hydrazinylidene]methyl]phenyl] 4-methylbenzoate
SYSTEMATIC NAME: [4-bromanyl-2-[[2-(dodecanoylamino)ethanoylhydrazinylidene]methyl]phenyl] 4-methylbenzoate
MOLECULAR FORMULA: C29H38BrN3O4
MOLECULAR WEIGHT: 572.53372
SMILES: CCCCCCCCCCCC(=O)NCC(=O)NN=CC1=C(C=CC(=C1)Br)OC(=O)C2=CC=C(C=C2)C
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Product OPENEYE NAME: 1-hydroxy-3-methyl-2-pent-2-enyl-anthracene-9,10-dione
CAS Name: 1-hydroxy-3-methyl-2-pent-2-enylanthracene-9,10-dione
IUPAC NAME: 1-hydroxy-3-methyl-2-pent-2-enylanthracene-9,10-dione
SYSTEMATIC NAME: 3-methyl-1-oxidanyl-2-pent-2-enyl-anthracene-9,10-dione
MOLECULAR FORMULA: C20H18O3
MOLECULAR WEIGHT: 306.35512
SMILES: CCC=CCC1=C(C=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)C
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Product OPENEYE NAME: 17-fluoro-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
CAS Name: 17-fluoro-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
IUPAC NAME: 17-fluoro-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: 17-fluoranyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C19H29FO
MOLECULAR WEIGHT: 292.431363
SMILES: CC12CCC(=O)CC1CCC3C2CCC4(C3CCC4F)C
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