Product OPENEYE NAME: methyl 2-[2-(4-ethoxybenzoyl)imino-6-nitro-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[2-[(4-ethoxyphenyl)-oxomethyl]imino-6-nitro-1,3-benzothiazol-3-yl]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-(4-ethoxybenzoyl)imino-6-nitro-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: methyl 2-[2-(4-ethoxyphenyl)carbonylimino-6-nitro-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C19H17N3O6S
MOLECULAR WEIGHT: 415.41978
SMILES: CCOC1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)[N+](=O)[O-])CC(=O)OC
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Product OPENEYE NAME: methyl 2-[2-(3,4-dimethylbenzoyl)imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[2-[(3,4-dimethylphenyl)-oxomethyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-(3,4-dimethylbenzoyl)imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: methyl 2-[2-(3,4-dimethylphenyl)carbonylimino-6-ethoxy-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C21H22N2O4S
MOLECULAR WEIGHT: 398.47538
SMILES: CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=C(C=C3)C)C)S2)CC(=O)OC
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Product OPENEYE NAME: ethyl 2-[6-chloro-2-(4-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[6-chloro-2-[(4-methylphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[6-chloro-2-(4-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: ethyl 2-[6-chloranyl-2-(4-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C19H17ClN2O3S
MOLECULAR WEIGHT: 388.86788
SMILES: CCOC(=O)CN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: ethyl 2-[2-(2-methylpropanoylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[2-(2-methyl-1-oxopropyl)imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[2-(2-methylpropanoylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: ethyl 2-[2-(2-methylpropanoylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C16H20N2O5S2
MOLECULAR WEIGHT: 384.4704
SMILES: CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C(C)C
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Product OPENEYE NAME: 5-bromo-N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]thiophene-2-carboxamide
CAS Name: 5-bromo-N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-thiophenecarboxamide
IUPAC NAME: 5-bromo-N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[4,6-bis(fluoranyl)-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-5-bromanyl-thiophene-2-carboxamide
MOLECULAR FORMULA: C15H11BrF2N2O2S2
MOLECULAR WEIGHT: 433.290846
SMILES: COCCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(S3)Br)F)F
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Product OPENEYE NAME: methyl 2-[4,6-difluoro-2-(3-methoxynaphthalene-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[4,6-difluoro-2-[(3-methoxy-2-naphthalenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester
IUPAC NAME: methyl 2-[4,6-difluoro-2-(3-methoxynaphthalene-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: methyl 2-[4,6-bis(fluoranyl)-2-(3-methoxynaphthalen-2-yl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C22H16F2N2O4S
MOLECULAR WEIGHT: 442.435246
SMILES: COC1=CC2=CC=CC=C2C=C1C(=O)N=C3N(C4=C(C=C(C=C4S3)F)F)CC(=O)OC
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Product OPENEYE NAME: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-acetamide
CAS Name: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenylacetamide
IUPAC NAME: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenylacetamide
SYSTEMATIC NAME: N-(4-fluoranyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-ethanamide
MOLECULAR FORMULA: C24H17FN2OS
MOLECULAR WEIGHT: 400.467983
SMILES: C#CCN1C2=C(C=CC=C2SC1=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)F
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Product OPENEYE NAME: N-(2,4-dimethylphenyl)-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydro-1H-quinoxalin-2-yl]acetamide
CAS Name: N-(2,4-dimethylphenyl)-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydro-1H-quinoxalin-2-yl]acetamide
IUPAC NAME: N-(2,4-dimethylphenyl)-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydro-1H-quinoxalin-2-yl]acetamide
SYSTEMATIC NAME: N-(2,4-dimethylphenyl)-2-[3-oxidanylidene-6-(trifluoromethyl)-2,4-dihydro-1H-quinoxalin-2-yl]ethanamide
MOLECULAR FORMULA: C19H18F3N3O2
MOLECULAR WEIGHT: 377.36033
SMILES: CC1=CC(=C(C=C1)NC(=O)CC2C(=O)NC3=C(N2)C=CC(=C3)C(F)(F)F)C
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Product OPENEYE NAME: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-piperidyl)propan-1-ol
CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-piperidinyl)-1-propanol
IUPAC NAME: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-piperidin-1-ylpropan-1-ol
SYSTEMATIC NAME: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-piperidin-1-yl-propan-1-ol
MOLECULAR FORMULA: C16H23NO3
MOLECULAR WEIGHT: 277.35872
SMILES: CC(C(C1=CC2=C(C=C1)OCCO2)O)N3CCCCC3
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Product OPENEYE NAME: N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-methoxy-benzamide
CAS Name: N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-methoxybenzamide
IUPAC NAME: N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-methoxybenzamide
SYSTEMATIC NAME: N-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-methoxy-benzamide
MOLECULAR FORMULA: C21H22N2O3
MOLECULAR WEIGHT: 350.41098
SMILES: CC1=C(C=C2C(=C1)C=C(C(=O)N2)CCNC(=O)C3=CC(=CC=C3)OC)C
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Product OPENEYE NAME: N-[[5-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
CAS Name: N-[[5-[[2-(3-methylanilino)-2-oxoethyl]thio]-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-thiophenecarboxamide
IUPAC NAME: N-[[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[[5-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C23H21N5O2S2
MOLECULAR WEIGHT: 463.57514
SMILES: CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC(=O)C4=CC=CS4
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Product OPENEYE NAME: 6-(3-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
CAS Name: 6-(3-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
IUPAC NAME: 6-(3-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
SYSTEMATIC NAME: 6-(3-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
MOLECULAR FORMULA: C10H7N5O2S
MOLECULAR WEIGHT: 261.25988
SMILES: C1C(=NN2C=NN=C2S1)C3=CC(=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: [3-(4-nitrophenyl)oxiran-2-yl]-(4-phenylphenyl)methanone
CAS Name: [3-(4-nitrophenyl)-2-oxiranyl]-(4-phenylphenyl)methanone
IUPAC NAME: [3-(4-nitrophenyl)oxiran-2-yl]-(4-phenylphenyl)methanone
SYSTEMATIC NAME: [3-(4-nitrophenyl)oxiran-2-yl]-(4-phenylphenyl)methanone
MOLECULAR FORMULA: C21H15NO4
MOLECULAR WEIGHT: 345.3481
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3C(O3)C4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: 3-(2,4-dimethoxyphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea
CAS Name: 3-(2,4-dimethoxyphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea
IUPAC NAME: 3-(2,4-dimethoxyphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea
SYSTEMATIC NAME: 3-(2,4-dimethoxyphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea
MOLECULAR FORMULA: C24H30N4O4S
MOLECULAR WEIGHT: 470.5844
SMILES: COC1=CC(=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3=C(C=C(C=C3)OC)OC)OC
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Product OPENEYE NAME: 3-[4-chloro-3-(trifluoromethyl)phenyl]-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea
CAS Name: 3-[4-chloro-3-(trifluoromethyl)phenyl]-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea
IUPAC NAME: 3-[4-chloro-3-(trifluoromethyl)phenyl]-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea
SYSTEMATIC NAME: 3-[4-chloranyl-3-(trifluoromethyl)phenyl]-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea
MOLECULAR FORMULA: C23H26ClF3N2O3S
MOLECULAR WEIGHT: 502.97735
SMILES: COC1=C(C(=C(C=C1)CN(C2CCCC2)C(=S)NC3=CC(=C(C=C3)Cl)C(F)(F)F)OC)OC
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Product OPENEYE NAME: 1-benzyl-2-(4-ethylphenyl)-4-hydroxy-3-(3-phenylprop-2-enoyl)-2H-pyrrol-5-one
CAS Name: 2-(4-ethylphenyl)-4-hydroxy-3-(1-oxo-3-phenylprop-2-enyl)-1-(phenylmethyl)-2H-pyrrol-5-one
IUPAC NAME: 1-benzyl-2-(4-ethylphenyl)-4-hydroxy-3-(3-phenylprop-2-enoyl)-2H-pyrrol-5-one
SYSTEMATIC NAME: 2-(4-ethylphenyl)-4-oxidanyl-1-(phenylmethyl)-3-(3-phenylprop-2-enoyl)-2H-pyrrol-5-one
MOLECULAR FORMULA: C28H25NO3
MOLECULAR WEIGHT: 423.503
SMILES: CCC1=CC=C(C=C1)C2C(=C(C(=O)N2CC3=CC=CC=C3)O)C(=O)C=CC4=CC=CC=C4
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Product OPENEYE NAME: N-(2-aminophenyl)-3-(4-aminophenyl)prop-2-enamide
CAS Name: N-(2-aminophenyl)-3-(4-aminophenyl)-2-propenamide
IUPAC NAME: N-(2-aminophenyl)-3-(4-aminophenyl)prop-2-enamide
SYSTEMATIC NAME: N-(2-aminophenyl)-3-(4-aminophenyl)prop-2-enamide
MOLECULAR FORMULA: C15H15N3O
MOLECULAR WEIGHT: 253.2991
SMILES: C1=CC=C(C(=C1)N)NC(=O)C=CC2=CC=C(C=C2)N
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Product OPENEYE NAME: 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5-methyl-benzoic acid
CAS Name: 2-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]-5-methylbenzoic acid
IUPAC NAME: 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5-methylbenzoic acid
SYSTEMATIC NAME: 2-[2-(4-chlorophenyl)sulfanylethanoylamino]-5-methyl-benzoic acid
MOLECULAR FORMULA: C16H14ClNO3S
MOLECULAR WEIGHT: 335.80526
SMILES: CC1=CC(=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Cl)C(=O)O
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Product OPENEYE NAME: N-[2-[5-[2-(4-ethylphenyl)-2-oxo-ethyl]sulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]ethyl]acetamide
CAS Name: N-[2-[5-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]ethyl]acetamide
IUPAC NAME: N-[2-[5-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[5-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]ethyl]ethanamide
MOLECULAR FORMULA: C23H26N4O3S
MOLECULAR WEIGHT: 438.54254
SMILES: CCC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)CCNC(=O)C
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Product OPENEYE NAME: N-[3-[4-(3,4-dichlorophenyl)-5-[2-oxo-2-[4-(1-piperidylsulfonyl)phenyl]ethyl]sulfanyl-1,2,4-triazol-3-yl]propyl]acetamide
CAS Name: N-[3-[4-(3,4-dichlorophenyl)-5-[[2-oxo-2-[4-(1-piperidinylsulfonyl)phenyl]ethyl]thio]-1,2,4-triazol-3-yl]propyl]acetamide
IUPAC NAME: N-[3-[4-(3,4-dichlorophenyl)-5-[2-oxo-2-(4-piperidin-1-ylsulfonylphenyl)ethyl]sulfanyl-1,2,4-triazol-3-yl]propyl]acetamide
SYSTEMATIC NAME: N-[3-[4-(3,4-dichlorophenyl)-5-[2-oxidanylidene-2-(4-piperidin-1-ylsulfonylphenyl)ethyl]sulfanyl-1,2,4-triazol-3-yl]propyl]ethanamide
MOLECULAR FORMULA: C26H29Cl2N5O4S2
MOLECULAR WEIGHT: 610.57556
SMILES: CC(=O)NCCCC1=NN=C(N1C2=CC(=C(C=C2)Cl)Cl)SCC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4
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Product OPENEYE NAME: 3-(2,6-diethylphenyl)-1-(3-morpholinopropyl)-1-(o-tolylmethyl)thiourea
CAS Name: 3-(2,6-diethylphenyl)-1-[(2-methylphenyl)methyl]-1-[3-(4-morpholinyl)propyl]thiourea
IUPAC NAME: 3-(2,6-diethylphenyl)-1-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea
SYSTEMATIC NAME: 3-(2,6-diethylphenyl)-1-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea
MOLECULAR FORMULA: C26H37N3OS
MOLECULAR WEIGHT: 439.65648
SMILES: CCC1=C(C(=CC=C1)CC)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=C3C
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Product OPENEYE NAME: 1-cyclopentyl-3-isopropyl-1-(4-pyridylmethyl)thiourea
CAS Name: 1-cyclopentyl-3-propan-2-yl-1-(pyridin-4-ylmethyl)thiourea
IUPAC NAME: 1-cyclopentyl-3-propan-2-yl-1-(pyridin-4-ylmethyl)thiourea
SYSTEMATIC NAME: 1-cyclopentyl-3-propan-2-yl-1-(pyridin-4-ylmethyl)thiourea
MOLECULAR FORMULA: C15H23N3S
MOLECULAR WEIGHT: 277.42822
SMILES: CC(C)NC(=S)N(CC1=CC=NC=C1)C2CCCC2
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Product OPENEYE NAME: 1-(1-naphthylmethyl)-3-(tetrahydrofuran-2-ylmethyl)thiourea
CAS Name: 1-(1-naphthalenylmethyl)-3-(2-oxolanylmethyl)thiourea
IUPAC NAME: 1-(naphthalen-1-ylmethyl)-3-(oxolan-2-ylmethyl)thiourea
SYSTEMATIC NAME: 1-(naphthalen-1-ylmethyl)-3-(oxolan-2-ylmethyl)thiourea
MOLECULAR FORMULA: C17H20N2OS
MOLECULAR WEIGHT: 300.4185
SMILES: C1CC(OC1)CNC(=S)NCC2=CC=CC3=CC=CC=C32
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