Product OPENEYE NAME: [3-(2-fluoroethoxy)-2-methoxy-phenyl]-[1-[2-(4-fluorophenyl)ethyl]-4-piperidyl]methanol
CAS Name: [3-(2-fluoroethoxy)-2-methoxyphenyl]-[1-[2-(4-fluorophenyl)ethyl]-4-piperidinyl]methanol
IUPAC NAME: [3-(2-fluoroethoxy)-2-methoxyphenyl]-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol
SYSTEMATIC NAME: [3-(2-fluoranylethoxy)-2-methoxy-phenyl]-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol
MOLECULAR FORMULA: C23H29F2NO3
MOLECULAR WEIGHT: 405.478066
SMILES: COC1=C(C=CC=C1OCCF)C(C2CCN(CC2)CCC3=CC=C(C=C3)F)O
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Product OPENEYE NAME: N-[(3R,4S)-4-[(5-chloro-1H-indole-2-carbonyl)amino]-1-(2-methoxyethyl)-3-piperidyl]-5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridine-2-carboxamide
CAS Name: N-[(3R,4S)-4-[[(5-chloro-1H-indol-2-yl)-oxomethyl]amino]-1-(2-methoxyethyl)-3-piperidinyl]-5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridine-2-carboxamide
IUPAC NAME: N-[(3R,4S)-4-[(5-chloro-1H-indole-2-carbonyl)amino]-1-(2-methoxyethyl)piperidin-3-yl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide
SYSTEMATIC NAME: N-[(3R,4S)-4-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-1-(2-methoxyethyl)piperidin-3-yl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide
MOLECULAR FORMULA: C25H31ClN6O3S
MOLECULAR WEIGHT: 531.07004
SMILES: CN1CCC2=C(C1)SC(=N2)C(=O)N[C@@H]3CN(CC[C@@H]3NC(=O)C4=CC5=C(N4)C=CC(=C5)Cl)CCOC
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Product OPENEYE NAME: (2S)-2-[[(2S)-3-cyclohexyl-2-sulfanyl-propanoyl]amino]-3-(4-phenylphenyl)propanoic acid
CAS Name: (2S)-2-[[(2S)-3-cyclohexyl-2-mercapto-1-oxopropyl]amino]-3-(4-phenylphenyl)propanoic acid
IUPAC NAME: (2S)-2-[[(2S)-3-cyclohexyl-2-sulfanylpropanoyl]amino]-3-(4-phenylphenyl)propanoic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-3-cyclohexyl-2-sulfanyl-propanoyl]amino]-3-(4-phenylphenyl)propanoic acid
MOLECULAR FORMULA: C24H29NO3S
MOLECULAR WEIGHT: 411.55696
SMILES: C1CCC(CC1)C[C@@H](C(=O)N[C@@H](CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)S
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Product OPENEYE NAME: (2S)-3-(4-phenylphenyl)-2-[[(2S)-2-phenyl-2-sulfanyl-acetyl]amino]propanoic acid
CAS Name: (2S)-2-[[(2S)-2-mercapto-1-oxo-2-phenylethyl]amino]-3-(4-phenylphenyl)propanoic acid
IUPAC NAME: (2S)-3-(4-phenylphenyl)-2-[[(2S)-2-phenyl-2-sulfanylacetyl]amino]propanoic acid
SYSTEMATIC NAME: (2S)-3-(4-phenylphenyl)-2-[[(2S)-2-phenyl-2-sulfanyl-ethanoyl]amino]propanoic acid
MOLECULAR FORMULA: C23H21NO3S
MOLECULAR WEIGHT: 391.48274
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C[C@@H](C(=O)O)NC(=O)[C@H](C3=CC=CC=C3)S
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Product OPENEYE NAME: (2S)-2-[[(2S)-4-methyl-2-sulfanyl-pentanoyl]amino]-3-(4-phenylphenyl)propanoic acid
CAS Name: (2S)-2-[[(2S)-2-mercapto-4-methyl-1-oxopentyl]amino]-3-(4-phenylphenyl)propanoic acid
IUPAC NAME: (2S)-2-[[(2S)-4-methyl-2-sulfanylpentanoyl]amino]-3-(4-phenylphenyl)propanoic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-4-methyl-2-sulfanyl-pentanoyl]amino]-3-(4-phenylphenyl)propanoic acid
MOLECULAR FORMULA: C21H25NO3S
MOLECULAR WEIGHT: 371.4931
SMILES: CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O)S
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Product OPENEYE NAME: 5-chloro-N-[6-(1H-imidazol-2-yl)-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
CAS Name: 5-chloro-N-[6-(1H-imidazol-2-yl)-9-bicyclo[4.2.1]nonanyl]-2-thiophenesulfonamide
IUPAC NAME: 5-chloro-N-[6-(1H-imidazol-2-yl)-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: 5-chloranyl-N-[6-(1H-imidazol-2-yl)-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C16H20ClN3O2S2
MOLECULAR WEIGHT: 385.9319
SMILES: C1CCC2(CCC(C1)C2NS(=O)(=O)C3=CC=C(S3)Cl)C4=NC=CN4
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Product OPENEYE NAME: 6-bromo-2-cyclohexyl-chromen-4-one
CAS Name: 6-bromo-2-cyclohexyl-1-benzopyran-4-one
IUPAC NAME: 6-bromo-2-cyclohexylchromen-4-one
SYSTEMATIC NAME: 6-bromanyl-2-cyclohexyl-chromen-4-one
MOLECULAR FORMULA: C15H15BrO2
MOLECULAR WEIGHT: 307.1824
SMILES: C1CCC(CC1)C2=CC(=O)C3=C(O2)C=CC(=C3)Br
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Product OPENEYE NAME: (2S)-2-isobutyl-4-[4-[(6-methoxy-8-quinolyl)amino]pentyl]-1,4-diazaspiro[4.6]undecan-3-one
CAS Name: (2S)-4-[4-[(6-methoxy-8-quinolinyl)amino]pentyl]-2-(2-methylpropyl)-1,4-diazaspiro[4.6]undecan-3-one
IUPAC NAME: (2S)-4-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-2-(2-methylpropyl)-1,4-diazaspiro[4.6]undecan-3-one
SYSTEMATIC NAME: (2S)-4-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-2-(2-methylpropyl)-1,4-diazaspiro[4.6]undecan-3-one
MOLECULAR FORMULA: C28H42N4O2
MOLECULAR WEIGHT: 466.65868
SMILES: CC(C)C[C@H]1C(=O)N(C2(N1)CCCCCC2)CCCC(C)NC3=C4C(=CC(=C3)OC)C=CC=N4
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Product OPENEYE NAME: (2S)-4-[4-[(6-methoxy-8-quinolyl)amino]pentyl]-2,8-dimethyl-1,4-diazaspiro[4.5]decan-3-one
CAS Name: (2S)-4-[4-[(6-methoxy-8-quinolinyl)amino]pentyl]-2,8-dimethyl-1,4-diazaspiro[4.5]decan-3-one
IUPAC NAME: (2S)-4-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-2,8-dimethyl-1,4-diazaspiro[4.5]decan-3-one
SYSTEMATIC NAME: (2S)-4-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-2,8-dimethyl-1,4-diazaspiro[4.5]decan-3-one
MOLECULAR FORMULA: C25H36N4O2
MOLECULAR WEIGHT: 424.57894
SMILES: C[C@H]1C(=O)N(C2(N1)CCC(CC2)C)CCCC(C)NC3=C4C(=CC(=C3)OC)C=CC=N4
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Product OPENEYE NAME: methyl 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxo-3,4-dihydro-1,8-naphthyridin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]methyl]piperidine-1-carboxylate
CAS Name: 4-[[[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-2-oxo-3,4-dihydro-1,8-naphthyridin-3-yl]-[(1-methyl-4-imidazolyl)sulfonyl]amino]methyl]-1-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxo-3,4-dihydro-1,8-naphthyridin-3-yl]-(1-methylimidazol-4-yl)sulfonylamino]methyl]piperidine-1-carboxylate
SYSTEMATIC NAME: methyl 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxidanylidene-3,4-dihydro-1,8-naphthyridin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]methyl]piperidine-1-carboxylate
MOLECULAR FORMULA: C26H31N9O5S
MOLECULAR WEIGHT: 581.64664
SMILES: CN1C=C(N=C1)S(=O)(=O)N(CC2CCN(CC2)C(=O)OC)C3CC4=C(N=CC(=C4)C#N)N(C3=O)CC5=CN=CN5C
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Product OPENEYE NAME: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxo-3,4-dihydro-1,8-naphthyridin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]pyridine-2-sulfonamide
CAS Name: N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-2-oxo-3,4-dihydro-1,8-naphthyridin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]-2-pyridinesulfonamide
IUPAC NAME: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxo-3,4-dihydro-1,8-naphthyridin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]pyridine-2-sulfonamide
SYSTEMATIC NAME: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxidanylidene-3,4-dihydro-1,8-naphthyridin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]pyridine-2-sulfonamide
MOLECULAR FORMULA: C27H25N7O5S2
MOLECULAR WEIGHT: 591.6613
SMILES: CN1C=NC=C1CN2C(=O)C(CC3=C2N=CC(=C3)C#N)N(CC4=CC=C(C=C4)S(=O)(=O)C)S(=O)(=O)C5=CC=CC=N5
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