Product OPENEYE NAME: 5-chloro-1-[2-(6-chloro-2-hydroxy-oxazolo[3,2-a]pyridin-4-ium-3-yl)-2-oxo-ethyl]pyridin-2-one
CAS Name: 5-chloro-1-[2-(6-chloro-2-hydroxy-3-oxazolo[3,2-a]pyridin-4-iumyl)-2-oxoethyl]-2-pyridinone
IUPAC NAME: 5-chloro-1-[2-(6-chloro-2-hydroxy-[1,3]oxazolo[3,2-a]pyridin-4-ium-3-yl)-2-oxoethyl]pyridin-2-one
SYSTEMATIC NAME: 5-chloranyl-1-[2-(6-chloranyl-2-oxidanyl-[1,3]oxazolo[3,2-a]pyridin-4-ium-3-yl)-2-oxidanylidene-ethyl]pyridin-2-one
MOLECULAR FORMULA: C14H9Cl2N2O4+
MOLECULAR WEIGHT: 340.13826
SMILES: C1=CC(=O)N(C=C1Cl)CC(=O)C2=C(OC3=[N+]2C=C(C=C3)Cl)O
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Product OPENEYE NAME: 2-(2,4-dichlorophenoxy)-1-[3-(4-ethoxyphenyl)-7-[(4-ethoxyphenyl)methylene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone
CAS Name: 2-(2,4-dichlorophenoxy)-1-[3-(4-ethoxyphenyl)-7-[(4-ethoxyphenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone
IUPAC NAME: 2-(2,4-dichlorophenoxy)-1-[3-(4-ethoxyphenyl)-7-[(4-ethoxyphenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone
SYSTEMATIC NAME: 2-[2,4-bis(chloranyl)phenoxy]-1-[3-(4-ethoxyphenyl)-7-[(4-ethoxyphenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone
MOLECULAR FORMULA: C32H32Cl2N2O4
MOLECULAR WEIGHT: 579.51348
SMILES: CCOC1=CC=C(C=C1)C=C2CCCC3C2=NN(C3C4=CC=C(C=C4)OCC)C(=O)COC5=C(C=C(C=C5)Cl)Cl
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Product OPENEYE NAME: 4-nitro-6-[[2-(3-phenyl-3,4-dihydropyrazol-5-ylidene)hydrazino]methylene]cyclohex-2-en-1-one
CAS Name: 4-nitro-6-[[2-(3-phenyl-3,4-dihydropyrazol-5-ylidene)hydrazinyl]methylidene]-1-cyclohex-2-enone
IUPAC NAME: 4-nitro-6-[[2-(3-phenyl-3,4-dihydropyrazol-5-ylidene)hydrazinyl]methylidene]cyclohex-2-en-1-one
SYSTEMATIC NAME: 4-nitro-6-[[2-(3-phenyl-3,4-dihydropyrazol-5-ylidene)hydrazinyl]methylidene]cyclohex-2-en-1-one
MOLECULAR FORMULA: C16H15N5O3
MOLECULAR WEIGHT: 325.322
SMILES: C1C(C=CC(=O)C1=CNN=C2CC(N=N2)C3=CC=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(4-chlorophenyl)-3-[5-fluoro-4-oxo-5-(trifluoromethyl)thiazol-2-yl]urea
CAS Name: 1-(4-chlorophenyl)-3-[5-fluoro-4-oxo-5-(trifluoromethyl)-2-thiazolyl]urea
IUPAC NAME: 1-(4-chlorophenyl)-3-[5-fluoro-4-oxo-5-(trifluoromethyl)-1,3-thiazol-2-yl]urea
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-[5-fluoranyl-4-oxidanylidene-5-(trifluoromethyl)-1,3-thiazol-2-yl]urea
MOLECULAR FORMULA: C11H6ClF4N3O2S
MOLECULAR WEIGHT: 355.695853
SMILES: C1=CC(=CC=C1NC(=O)NC2=NC(=O)C(S2)(C(F)(F)F)F)Cl
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Product OPENEYE NAME: 4-methoxy-N-[(2,3,4-trimethoxyphenyl)methyleneamino]benzamide
CAS Name: 4-methoxy-N-[(2,3,4-trimethoxyphenyl)methylideneamino]benzamide
IUPAC NAME: 4-methoxy-N-[(2,3,4-trimethoxyphenyl)methylideneamino]benzamide
SYSTEMATIC NAME: 4-methoxy-N-[(2,3,4-trimethoxyphenyl)methylideneamino]benzamide
MOLECULAR FORMULA: C18H20N2O5
MOLECULAR WEIGHT: 344.3618
SMILES: COC1=CC=C(C=C1)C(=O)NN=CC2=C(C(=C(C=C2)OC)OC)OC
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Product OPENEYE NAME: N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-methyl-furan-3-carboxamide
CAS Name: N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-methyl-3-furancarboxamide
IUPAC NAME: N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-methylfuran-3-carboxamide
SYSTEMATIC NAME: N-[1,3-bis(oxidanylidene)-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-2-methyl-furan-3-carboxamide
MOLECULAR FORMULA: C14H16N2O4
MOLECULAR WEIGHT: 276.28784
SMILES: CC1=C(C=CO1)C(=O)NN2C(=O)C3CCCCC3C2=O
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Product OPENEYE NAME: 3-[2-carboxyethyl(dimethylamino)amino]propanoic acid
CAS Name: 3-[2-carboxyethyl(dimethylamino)amino]propanoic acid
IUPAC NAME: 3-[2-carboxyethyl(dimethylamino)amino]propanoic acid
SYSTEMATIC NAME: 3-[dimethylamino(3-hydroxy-3-oxopropyl)amino]propanoic acid
MOLECULAR FORMULA: C8H16N2O4
MOLECULAR WEIGHT: 204.22364
SMILES: CN(C)N(CCC(=O)O)CCC(=O)O
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Product OPENEYE NAME: 5-[(3-isopropoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-5-oxo-pentanoic acid
CAS Name: 5-oxo-5-[[3-[oxo(propan-2-yloxy)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]pentanoic acid
IUPAC NAME: 5-oxo-5-[(3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]pentanoic acid
SYSTEMATIC NAME: 5-oxidanylidene-5-[(3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]pentanoic acid
MOLECULAR FORMULA: C17H23NO5S
MOLECULAR WEIGHT: 353.43322
SMILES: CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCCC(=O)O
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Product OPENEYE NAME: methyl N-[(3-fluorophenyl)methyleneamino]carbamate
CAS Name: N-[(3-fluorophenyl)methylideneamino]carbamic acid methyl ester
IUPAC NAME: methyl N-[(3-fluorophenyl)methylideneamino]carbamate
SYSTEMATIC NAME: methyl N-[(3-fluorophenyl)methylideneamino]carbamate
MOLECULAR FORMULA: C9H9FN2O2
MOLECULAR WEIGHT: 196.178363
SMILES: COC(=O)NN=CC1=CC(=CC=C1)F
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Product OPENEYE NAME: 4-phenyl-4-(p-tolylsulfonylhydrazono)butanoic acid
CAS Name: 4-[(4-methylphenyl)sulfonylhydrazinylidene]-4-phenylbutanoic acid
IUPAC NAME: 4-[(4-methylphenyl)sulfonylhydrazinylidene]-4-phenylbutanoic acid
SYSTEMATIC NAME: 4-[(4-methylphenyl)sulfonylhydrazinylidene]-4-phenyl-butanoic acid
MOLECULAR FORMULA: C17H18N2O4S
MOLECULAR WEIGHT: 346.40082
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN=C(CCC(=O)O)C2=CC=CC=C2
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Product OPENEYE NAME: 4-oxo-N-(4-pyridylmethyl)-4-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]butanamide
CAS Name: 4-oxo-N-(pyridin-4-ylmethyl)-4-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)-1-piperidinyl]butanamide
IUPAC NAME: 4-oxo-N-(pyridin-4-ylmethyl)-4-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]butanamide
SYSTEMATIC NAME: 4-oxidanylidene-N-(pyridin-4-ylmethyl)-4-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]butanamide
MOLECULAR FORMULA: C21H23N5O3S
MOLECULAR WEIGHT: 425.50402
SMILES: C1CN(CCC1C2=NC(=NO2)C3=CC=CS3)C(=O)CCC(=O)NCC4=CC=NC=C4
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Product OPENEYE NAME: 6-(cyclohexylamino)-1-[(3,5-dimethylphenyl)methyl]-3-methyl-pyrimidine-2,4-dione
CAS Name: 6-(cyclohexylamino)-1-[(3,5-dimethylphenyl)methyl]-3-methylpyrimidine-2,4-dione
IUPAC NAME: 6-(cyclohexylamino)-1-[(3,5-dimethylphenyl)methyl]-3-methylpyrimidine-2,4-dione
SYSTEMATIC NAME: 6-(cyclohexylamino)-1-[(3,5-dimethylphenyl)methyl]-3-methyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C20H27N3O2
MOLECULAR WEIGHT: 341.44728
SMILES: CC1=CC(=CC(=C1)CN2C(=CC(=O)N(C2=O)C)NC3CCCCC3)C
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Product OPENEYE NAME: ethyl 4-[6-phenyl-2-(4-pyridyl)pyrimidin-4-yl]piperazine-1-carboxylate
CAS Name: 4-(6-phenyl-2-pyridin-4-yl-4-pyrimidinyl)-1-piperazinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-(6-phenyl-2-pyridin-4-ylpyrimidin-4-yl)piperazine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-(6-phenyl-2-pyridin-4-yl-pyrimidin-4-yl)piperazine-1-carboxylate
MOLECULAR FORMULA: C22H23N5O2
MOLECULAR WEIGHT: 389.45032
SMILES: CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C3=CC=CC=C3)C4=CC=NC=C4
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Product OPENEYE NAME: 8-[6-(4-fluorophenyl)-2-(4-pyridyl)pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
CAS Name: 8-[6-(4-fluorophenyl)-2-pyridin-4-yl-4-pyrimidinyl]-1,4-dioxa-8-azaspiro[4.5]decane
IUPAC NAME: 8-[6-(4-fluorophenyl)-2-pyridin-4-ylpyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
SYSTEMATIC NAME: 8-[6-(4-fluorophenyl)-2-pyridin-4-yl-pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
MOLECULAR FORMULA: C22H21FN4O2
MOLECULAR WEIGHT: 392.426143
SMILES: C1CN(CCC12OCCO2)C3=NC(=NC(=C3)C4=CC=C(C=C4)F)C5=CC=NC=C5
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Product OPENEYE NAME: 2-[butyl(p-tolylsulfonyl)amino]-N-(4-methylthiazol-2-yl)acetamide
CAS Name: 2-[butyl-(4-methylphenyl)sulfonylamino]-N-(4-methyl-2-thiazolyl)acetamide
IUPAC NAME: 2-[butyl-(4-methylphenyl)sulfonylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-[butyl-(4-methylphenyl)sulfonyl-amino]-N-(4-methyl-1,3-thiazol-2-yl)ethanamide
MOLECULAR FORMULA: C17H23N3O3S2
MOLECULAR WEIGHT: 381.51282
SMILES: CCCCN(CC(=O)NC1=NC(=CS1)C)S(=O)(=O)C2=CC=C(C=C2)C
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Product OPENEYE NAME: N-isopentyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-2-phenyl-butanamide
CAS Name: N-(3-methylbutyl)-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-2-phenylbutanamide
IUPAC NAME: N-(3-methylbutyl)-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-phenylbutanamide
SYSTEMATIC NAME: N-(3-methylbutyl)-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-2-phenyl-butanamide
MOLECULAR FORMULA: C21H29N3O3
MOLECULAR WEIGHT: 371.47326
SMILES: CCC(C1=CC=CC=C1)C(=O)N(CCC(C)C)CC(=O)NC2=NOC(=C2)C
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Product OPENEYE NAME: 2-[(2,3-dimethylphenyl)carbamoyl-propyl-amino]-N-isoxazol-3-yl-acetamide
CAS Name: 2-[[(2,3-dimethylanilino)-oxomethyl]-propylamino]-N-(3-isoxazolyl)acetamide
IUPAC NAME: 2-[(2,3-dimethylphenyl)carbamoyl-propylamino]-N-(1,2-oxazol-3-yl)acetamide
SYSTEMATIC NAME: 2-[(2,3-dimethylphenyl)carbamoyl-propyl-amino]-N-(1,2-oxazol-3-yl)ethanamide
MOLECULAR FORMULA: C17H22N4O3
MOLECULAR WEIGHT: 330.38158
SMILES: CCCN(CC(=O)NC1=NOC=C1)C(=O)NC2=CC=CC(=C2C)C
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Product OPENEYE NAME: 4-chloro-N-(2-morpholinoethyl)-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]benzamide
CAS Name: 4-chloro-N-[2-(4-morpholinyl)ethyl]-N-[2-oxo-2-(2-thiazolylamino)ethyl]benzamide
IUPAC NAME: 4-chloro-N-(2-morpholin-4-ylethyl)-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide
SYSTEMATIC NAME: 4-chloranyl-N-(2-morpholin-4-ylethyl)-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide
MOLECULAR FORMULA: C18H21ClN4O3S
MOLECULAR WEIGHT: 408.90234
SMILES: C1COCCN1CCN(CC(=O)NC2=NC=CS2)C(=O)C3=CC=C(C=C3)Cl
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