Product OPENEYE NAME: [(1S)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C15H19NO6
MOLECULAR WEIGHT: 309.31446
SMILES: C[C@@H](C(=O)NC(=O)OC)OC(=O)CCC1=CC=C(C=C1)OC
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Product OPENEYE NAME: [2-(cyclopropylcarbamoylamino)-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [2-[[(cyclopropylamino)-oxomethyl]amino]-2-oxoethyl] ester
IUPAC NAME: [2-(cyclopropylcarbamoylamino)-2-oxoethyl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C17H16N2O6
MOLECULAR WEIGHT: 344.31874
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC(=O)NC(=O)NC3CC3
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Product OPENEYE NAME: methyl 6-[[[2-(1-adamantyl)acetyl]amino]carbamothioylamino]hexanoate
CAS Name: 6-[[[[2-(1-adamantyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]hexanoic acid methyl ester
IUPAC NAME: methyl 6-[[[2-(1-adamantyl)acetyl]amino]carbamothioylamino]hexanoate
SYSTEMATIC NAME: methyl 6-[[2-(1-adamantyl)ethanoylamino]carbamothioylamino]hexanoate
MOLECULAR FORMULA: C20H33N3O3S
MOLECULAR WEIGHT: 395.55932
SMILES: COC(=O)CCCCCNC(=S)NNC(=O)CC12CC3CC(C1)CC(C3)C2
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Product OPENEYE NAME: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone
CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]ethanone
IUPAC NAME: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone
SYSTEMATIC NAME: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone
MOLECULAR FORMULA: C23H30N3O3S+
MOLECULAR WEIGHT: 428.5676
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N3CCCC4=CC=CC=C43)C
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Product OPENEYE NAME: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanone
CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]ethanone
IUPAC NAME: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanone
SYSTEMATIC NAME: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanone
MOLECULAR FORMULA: C23H29N3O3S
MOLECULAR WEIGHT: 427.55966
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N3CCCC4=CC=CC=C43)C
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Product OPENEYE NAME: (2S)-N-(2-isopropyl-6-methyl-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2S)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-(2-methyl-6-propan-2-ylphenyl)propanamide
IUPAC NAME: (2S)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-(2-methyl-6-propan-2-ylphenyl)propanamide
SYSTEMATIC NAME: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-(2-methyl-6-propan-2-yl-phenyl)propanamide
MOLECULAR FORMULA: C24H27N3OS
MOLECULAR WEIGHT: 405.55568
SMILES: CC1=C(C(=CC=C1)C(C)C)NC(=O)[C@H](C)SC2=NC(=CC(=N2)C)C3=CC=CC=C3
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Product OPENEYE NAME: N-(3-chlorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
CAS Name: N-(3-chlorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-(3-chlorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-(3-chlorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C20H25ClN3O3S+
MOLECULAR WEIGHT: 422.9488
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)Cl)C
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Product OPENEYE NAME: N-(3-chlorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
CAS Name: N-(3-chlorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-(3-chlorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(3-chlorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H24ClN3O3S
MOLECULAR WEIGHT: 421.94086
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)Cl)C
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Product OPENEYE NAME: [(1R)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C15H19NO6
MOLECULAR WEIGHT: 309.31446
SMILES: C[C@H](C(=O)NC(=O)OC)OC(=O)CCC1=CC=C(C=C1)OC
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Product OPENEYE NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-[(1R,2R)-2-methylcyclohexyl]thiourea
CAS Name: 1-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-[(1R,2R)-2-methylcyclohexyl]thiourea
IUPAC NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-[(1R,2R)-2-methylcyclohexyl]thiourea
SYSTEMATIC NAME: 1-[2-(1-adamantyl)ethanoylamino]-3-[(1R,2R)-2-methylcyclohexyl]thiourea
MOLECULAR FORMULA: C20H33N3OS
MOLECULAR WEIGHT: 363.56052
SMILES: C[C@@H]1CCCC[C@H]1NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: (2S)-N-(4-fluoro-3-nitro-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2S)-N-(4-fluoro-3-nitrophenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide
IUPAC NAME: (2S)-N-(4-fluoro-3-nitrophenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide
SYSTEMATIC NAME: (2S)-N-(4-fluoranyl-3-nitro-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
MOLECULAR FORMULA: C20H17FN4O3S
MOLECULAR WEIGHT: 412.437383
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-[(1R,2S)-2-methylcyclohexyl]thiourea
CAS Name: 1-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-[(1R,2S)-2-methylcyclohexyl]thiourea
IUPAC NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-[(1R,2S)-2-methylcyclohexyl]thiourea
SYSTEMATIC NAME: 1-[2-(1-adamantyl)ethanoylamino]-3-[(1R,2S)-2-methylcyclohexyl]thiourea
MOLECULAR FORMULA: C20H33N3OS
MOLECULAR WEIGHT: 363.56052
SMILES: C[C@H]1CCCC[C@H]1NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [2-[[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]amino]-2-oxoethyl] ester
IUPAC NAME: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxoethyl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C22H24N2O6
MOLECULAR WEIGHT: 412.43576
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC(=O)NC(=O)NCCC3=CCCCC3
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-ethylphenyl)acetamide
CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(4-ethylphenyl)acetamide
IUPAC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-ethylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-ethylphenyl)ethanamide
MOLECULAR FORMULA: C22H30N3O3S+
MOLECULAR WEIGHT: 416.5569
SMILES: CCC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)acetamide
CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(4-ethylphenyl)acetamide
IUPAC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)ethanamide
MOLECULAR FORMULA: C22H29N3O3S
MOLECULAR WEIGHT: 415.54896
SMILES: CCC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C
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Product OPENEYE NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-[(1S,2R)-2-methylcyclohexyl]thiourea
CAS Name: 1-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-[(1S,2R)-2-methylcyclohexyl]thiourea
IUPAC NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-[(1S,2R)-2-methylcyclohexyl]thiourea
SYSTEMATIC NAME: 1-[2-(1-adamantyl)ethanoylamino]-3-[(1S,2R)-2-methylcyclohexyl]thiourea
MOLECULAR FORMULA: C20H33N3OS
MOLECULAR WEIGHT: 363.56052
SMILES: C[C@@H]1CCCC[C@@H]1NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [2-oxo-2-[3-(2-oxo-1-pyrrolidinyl)phenyl]ethyl] ester
IUPAC NAME: [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethyl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C22H23NO5
MOLECULAR WEIGHT: 381.42172
SMILES: COC1=CC=C(C=C1)CCC(=O)OCC(=O)C2=CC(=CC=C2)N3CCCC3=O
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Product OPENEYE NAME: (2R)-N-(4-fluoro-3-nitro-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2R)-N-(4-fluoro-3-nitrophenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide
IUPAC NAME: (2R)-N-(4-fluoro-3-nitrophenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide
SYSTEMATIC NAME: (2R)-N-(4-fluoranyl-3-nitro-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
MOLECULAR FORMULA: C20H17FN4O3S
MOLECULAR WEIGHT: 412.437383
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@H](C)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea
CAS Name: 1-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea
IUPAC NAME: 1-[[2-(1-adamantyl)acetyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea
SYSTEMATIC NAME: 1-[2-(1-adamantyl)ethanoylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea
MOLECULAR FORMULA: C20H33N3OS
MOLECULAR WEIGHT: 363.56052
SMILES: C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)C3
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Product OPENEYE NAME: (2S)-N-(4-cyanophenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2S)-N-(4-cyanophenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide
IUPAC NAME: (2S)-N-(4-cyanophenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide
SYSTEMATIC NAME: (2S)-N-(4-cyanophenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
MOLECULAR FORMULA: C21H18N4OS
MOLECULAR WEIGHT: 374.45882
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC3=CC=C(C=C3)C#N
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-isopropylphenyl)acetamide
CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-propan-2-ylphenyl)acetamide
IUPAC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-propan-2-ylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-propan-2-ylphenyl)ethanamide
MOLECULAR FORMULA: C23H32N3O3S+
MOLECULAR WEIGHT: 430.58348
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(C)C)C
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-isopropylphenyl)acetamide
CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(2-propan-2-ylphenyl)acetamide
IUPAC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-propan-2-ylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-propan-2-ylphenyl)ethanamide
MOLECULAR FORMULA: C23H31N3O3S
MOLECULAR WEIGHT: 429.57554
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3C(C)C)C
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Product OPENEYE NAME: 1-[[2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetyl]amino]-3-methyl-thiourea
CAS Name: 1-[[2-[(4-chlorophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-3-methylthiourea
IUPAC NAME: 1-[[2-[(4-chlorophenyl)sulfonyl-methylamino]acetyl]amino]-3-methylthiourea
SYSTEMATIC NAME: 1-[2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoylamino]-3-methyl-thiourea
MOLECULAR FORMULA: C11H15ClN4O3S2
MOLECULAR WEIGHT: 350.8448
SMILES: CNC(=S)NNC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)Cl
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