Product OPENEYE NAME: N-(2-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
CAS Name: N-(2-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-(2-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C21H24N4O3S
MOLECULAR WEIGHT: 412.50526
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3C#N)C
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Product OPENEYE NAME: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)propanamide
CAS Name: (2S)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-(2,3,4-trifluorophenyl)propanamide
IUPAC NAME: (2S)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)propanamide
SYSTEMATIC NAME: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[2,3,4-tris(fluoranyl)phenyl]propanamide
MOLECULAR FORMULA: C20H16F3N3OS
MOLECULAR WEIGHT: 403.42075
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC3=C(C(=C(C=C3)F)F)F
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Product OPENEYE NAME: N-(3-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
CAS Name: N-(3-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-(3-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-(3-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C21H25N4O3S+
MOLECULAR WEIGHT: 413.5132
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3)C#N)C
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Product OPENEYE NAME: N-(3-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
CAS Name: N-(3-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-(3-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(3-cyanophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C21H24N4O3S
MOLECULAR WEIGHT: 412.50526
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC(=C3)C#N)C
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Product OPENEYE NAME: [(1R)-3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-1-methyl-2-oxo-propyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-4-cyano-4-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutan-2-yl] ester
IUPAC NAME: [(2R)-4-cyano-4-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-4-cyano-4-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C22H21N3O4
MOLECULAR WEIGHT: 391.41984
SMILES: C[C@H](C(=O)C(=C1NC2=CC=CC=C2N1)C#N)OC(=O)CCC3=CC=C(C=C3)OC
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Product OPENEYE NAME: [2-(2,3-dimethyl-6-nitro-anilino)-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [2-(2,3-dimethyl-6-nitroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2,3-dimethyl-6-nitroanilino)-2-oxoethyl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C21H18N2O7
MOLECULAR WEIGHT: 410.37682
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC(=O)NC3=C(C=CC(=C3C)C)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-(1,3-benzodioxol-5-ylmethyl)thiourea
CAS Name: 1-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-(1,3-benzodioxol-5-ylmethyl)thiourea
IUPAC NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-(1,3-benzodioxol-5-ylmethyl)thiourea
SYSTEMATIC NAME: 1-[2-(1-adamantyl)ethanoylamino]-3-(1,3-benzodioxol-5-ylmethyl)thiourea
MOLECULAR FORMULA: C21H27N3O3S
MOLECULAR WEIGHT: 401.52238
SMILES: C1C2CC3CC1CC(C2)(C3)CC(=O)NNC(=S)NCC4=CC5=C(C=C4)OCO5
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-indolin-1-yl-ethanone
CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]ethanone
IUPAC NAME: 1-(2,3-dihydroindol-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone
SYSTEMATIC NAME: 1-(2,3-dihydroindol-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone
MOLECULAR FORMULA: C22H28N3O3S+
MOLECULAR WEIGHT: 414.54102
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N3CCC4=CC=CC=C43)C
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Product OPENEYE NAME: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] ester
IUPAC NAME: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C21H22N2O5
MOLECULAR WEIGHT: 382.40978
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC(=O)N(C)C3(CCCCC3)C#N
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Product OPENEYE NAME: (2R)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)propanamide
CAS Name: (2R)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-(2,3,4-trifluorophenyl)propanamide
IUPAC NAME: (2R)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)propanamide
SYSTEMATIC NAME: (2R)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[2,3,4-tris(fluoranyl)phenyl]propanamide
MOLECULAR FORMULA: C20H16F3N3OS
MOLECULAR WEIGHT: 403.42075
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@H](C)C(=O)NC3=C(C(=C(C=C3)F)F)F
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2R)-2-methylindolin-1-yl]ethanone
CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
IUPAC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
MOLECULAR FORMULA: C23H30N3O3S+
MOLECULAR WEIGHT: 428.5676
SMILES: C[C@@H]1CC2=CC=CC=C2N1C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)C)C
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(2R)-2-methylindolin-1-yl]ethanone
CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
IUPAC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
MOLECULAR FORMULA: C23H29N3O3S
MOLECULAR WEIGHT: 427.55966
SMILES: C[C@@H]1CC2=CC=CC=C2N1C(=O)CN3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)C)C
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Product OPENEYE NAME: (3-methoxycarbonylphenyl)methyl 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid (3-methoxycarbonylphenyl)methyl ester
IUPAC NAME: (3-methoxycarbonylphenyl)methyl 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: (3-methoxycarbonylphenyl)methyl 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C20H16O6
MOLECULAR WEIGHT: 352.33744
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC3=CC=CC(=C3)C(=O)OC
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Product OPENEYE NAME: 4-[[(2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylpropanoyl]amino]benzamide
CAS Name: 4-[[(2S)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxopropyl]amino]benzamide
IUPAC NAME: 4-[[(2S)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanoyl]amino]benzamide
SYSTEMATIC NAME: 4-[[(2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylpropanoyl]amino]benzamide
MOLECULAR FORMULA: C21H20N4O2S
MOLECULAR WEIGHT: 392.4741
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC3=CC=C(C=C3)C(=O)N
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2S)-2-methylindolin-1-yl]ethanone
CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone
IUPAC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone
MOLECULAR FORMULA: C23H30N3O3S+
MOLECULAR WEIGHT: 428.5676
SMILES: C[C@H]1CC2=CC=CC=C2N1C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)C)C
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(2S)-2-methylindolin-1-yl]ethanone
CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone
IUPAC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone
MOLECULAR FORMULA: C23H29N3O3S
MOLECULAR WEIGHT: 427.55966
SMILES: C[C@H]1CC2=CC=CC=C2N1C(=O)CN3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)C)C
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Product OPENEYE NAME: [(1S)-1-(3-nitrophenyl)ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(1S)-1-(3-nitrophenyl)ethyl] ester
IUPAC NAME: [(1S)-1-(3-nitrophenyl)ethyl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(1S)-1-(3-nitrophenyl)ethyl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C18H19NO5
MOLECULAR WEIGHT: 329.34716
SMILES: C[C@@H](C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CCC2=CC=C(C=C2)OC
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