Product OPENEYE NAME: 1-[[4-(4-chlorophenoxy)phenyl]sulfonylmethyl]-3-hydroxy-pyridin-2-one
CAS Name: 1-[[4-(4-chlorophenoxy)phenyl]sulfonylmethyl]-3-hydroxy-2-pyridinone
IUPAC NAME: 1-[[4-(4-chlorophenoxy)phenyl]sulfonylmethyl]-3-hydroxypyridin-2-one
SYSTEMATIC NAME: 1-[[4-(4-chloranylphenoxy)phenyl]sulfonylmethyl]-3-oxidanyl-pyridin-2-one
MOLECULAR FORMULA: C18H14ClNO5S
MOLECULAR WEIGHT: 391.82546
SMILES: C1=CN(C(=O)C(=C1)O)CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 3-dodecylsulfonyl-1,1,1-trifluoro-propan-2-one
CAS Name: 3-dodecylsulfonyl-1,1,1-trifluoro-2-propanone
IUPAC NAME: 3-dodecylsulfonyl-1,1,1-trifluoropropan-2-one
SYSTEMATIC NAME: 3-dodecylsulfonyl-1,1,1-tris(fluoranyl)propan-2-one
MOLECULAR FORMULA: C15H27F3O3S
MOLECULAR WEIGHT: 344.43329
SMILES: CCCCCCCCCCCCS(=O)(=O)CC(=O)C(F)(F)F
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Product OPENEYE NAME: (2S,3R,4S,5S,6S)-3-[(2S,3S,4S,5R,6S)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-6-[(2S,3R,4S,5S,6S)-5-amino-4-hydroxy-2-(hydroxymethyl)-6-[(2S,3R,4S,5S,6S)-4,5,6-trihydroxy-2-propoxycarbonyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-3-
CAS Name: (2S,3R,4S,5S,6S)-3-[[(2S,3S,4S,5R,6S)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-6-[[(2S,3R,4S,5S,6S)-5-amino-4-hydroxy-2-(hydroxymethyl)-6-[[(2S,3R,4S,5S,6S)-4,5,6-trihydroxy-2-[oxo(propoxy)methyl]-3-oxanyl]oxy]-3-oxanyl]oxy]-4,5-dihydroxy-2-o
IUPAC NAME: (2S,3R,4S,5S,6S)-3-[(2S,3S,4S,5R,6S)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(2S,3R,4S,5S,6S)-5-amino-4-hydroxy-2-(hydroxymethyl)-6-[(2S,3R,4S,5S,6S)-4,5,6-trihydroxy-2-propoxycarbonyloxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxane-2-carboxy
SYSTEMATIC NAME: (2S,3R,4S,5S,6S)-3-[(2S,3S,4S,5R,6S)-3-azanyl-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-6-[(2S,3R,4S,5S,6S)-5-azanyl-2-(hydroxymethyl)-4-oxidanyl-6-[(2S,3R,4S,5S,6S)-4,5,6-tris(oxidanyl)-2-propoxycarbonyl-oxan-3-yl]oxy-oxan-3-yl]oxy-4,5-bis(oxidany
MOLECULAR FORMULA: C27H46N2O21
MOLECULAR WEIGHT: 734.65494
SMILES: CCCOC(=O)[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)O)O)O)O[C@H]2[C@H]([C@@H]([C@H]([C@@H](O2)CO)O[C@@H]3[C@H]([C@@H]([C@H]([C@H](O3)C(=O)O)O[C@H]4[C@H]([C@@H]([C@H]([C@@H](O4)CO)O)O)N)O)O)O)N
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Product OPENEYE NAME: 3-hydroxy-1-[[4-(4-methoxyphenoxy)phenyl]sulfonylmethyl]pyridin-2-one
CAS Name: 3-hydroxy-1-[[4-(4-methoxyphenoxy)phenyl]sulfonylmethyl]-2-pyridinone
IUPAC NAME: 3-hydroxy-1-[[4-(4-methoxyphenoxy)phenyl]sulfonylmethyl]pyridin-2-one
SYSTEMATIC NAME: 1-[[4-(4-methoxyphenoxy)phenyl]sulfonylmethyl]-3-oxidanyl-pyridin-2-one
MOLECULAR FORMULA: C19H17NO6S
MOLECULAR WEIGHT: 387.40638
SMILES: COC1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)CN3C=CC=C(C3=O)O
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Product OPENEYE NAME: [(1R,3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]-1-piperidyl]-3-[[3-(1-methyltetrazol-5-yl)phenyl]carbamoylamino]butyl] N-methylcarbamate
CAS Name: N-methylcarbamic acid [(1R,3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]-1-piperidinyl]-3-[[[3-(1-methyl-5-tetrazolyl)anilino]-oxomethyl]amino]butyl] ester
IUPAC NAME: [(1R,3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]-3-[[3-(1-methyltetrazol-5-yl)phenyl]carbamoylamino]butyl] N-methylcarbamate
SYSTEMATIC NAME: [(1R,3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]-3-[[3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]carbamoylamino]butyl] N-methylcarbamate
MOLECULAR FORMULA: C27H35FN8O3
MOLECULAR WEIGHT: 538.617003
SMILES: C[C@H](C[C@H](N1CCC[C@H](C1)CC2=CC=C(C=C2)F)OC(=O)NC)NC(=O)NC3=CC=CC(=C3)C4=NN=NN4C
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Product OPENEYE NAME: 1-[(1R)-1-[(2R)-2-[(3S)-3-[(4-fluorophenyl)methyl]-1-piperidyl]-2-hydroxy-ethyl]-3-methyl-butyl]-3-[3-(1-methyltetrazol-5-yl)phenyl]urea
CAS Name: 1-[(1R,3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]-1-piperidinyl]-1-hydroxy-5-methylhexan-3-yl]-3-[3-(1-methyl-5-tetrazolyl)phenyl]urea
IUPAC NAME: 1-[(1R,3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]-1-hydroxy-5-methylhexan-3-yl]-3-[3-(1-methyltetrazol-5-yl)phenyl]urea
SYSTEMATIC NAME: 1-[(1R,3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]-5-methyl-1-oxidanyl-hexan-3-yl]-3-[3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]urea
MOLECULAR FORMULA: C28H38FN7O2
MOLECULAR WEIGHT: 523.645423
SMILES: CC(C)C[C@H](C[C@H](N1CCC[C@H](C1)CC2=CC=C(C=C2)F)O)NC(=O)NC3=CC=CC(=C3)C4=NN=NN4C
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Product OPENEYE NAME: 1-[(1S)-3-[(3S)-3-[(4-fluorophenyl)methyl]-1-piperidyl]-1-methyl-3-oxo-propyl]-3-[3-(1-methyltetrazol-5-yl)phenyl]urea
CAS Name: 1-[(2S)-4-[(3S)-3-[(4-fluorophenyl)methyl]-1-piperidinyl]-4-oxobutan-2-yl]-3-[3-(1-methyl-5-tetrazolyl)phenyl]urea
IUPAC NAME: 1-[(2S)-4-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]-4-oxobutan-2-yl]-3-[3-(1-methyltetrazol-5-yl)phenyl]urea
SYSTEMATIC NAME: 1-[(2S)-4-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]-4-oxidanylidene-butan-2-yl]-3-[3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]urea
MOLECULAR FORMULA: C25H30FN7O2
MOLECULAR WEIGHT: 479.549803
SMILES: C[C@@H](CC(=O)N1CCC[C@H](C1)CC2=CC=C(C=C2)F)NC(=O)NC3=CC=CC(=C3)C4=NN=NN4C
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Product OPENEYE NAME: 1-[(1R)-1-[2-[(3S)-3-[(4-fluorophenyl)methyl]-1-piperidyl]ethyl]butyl]-3-[3-(1-hydroxy-1-methyl-ethyl)-5-(1-methyltetrazol-5-yl)phenyl]urea
CAS Name: 1-[(3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]-1-piperidinyl]hexan-3-yl]-3-[3-(2-hydroxypropan-2-yl)-5-(1-methyl-5-tetrazolyl)phenyl]urea
IUPAC NAME: 1-[(3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]hexan-3-yl]-3-[3-(2-hydroxypropan-2-yl)-5-(1-methyltetrazol-5-yl)phenyl]urea
SYSTEMATIC NAME: 1-[(3R)-1-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]hexan-3-yl]-3-[3-(1-methyl-1,2,3,4-tetrazol-5-yl)-5-(2-oxidanylpropan-2-yl)phenyl]urea
MOLECULAR FORMULA: C30H42FN7O2
MOLECULAR WEIGHT: 551.698583
SMILES: CCC[C@H](CCN1CCC[C@H](C1)CC2=CC=C(C=C2)F)NC(=O)NC3=CC(=CC(=C3)C(C)(C)O)C4=NN=NN4C
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Product OPENEYE NAME: 4-chloro-2-[[methyl-(1-methyl-4-piperidyl)amino]methyl]benzonitrile
CAS Name: 4-chloro-2-[[methyl-(1-methyl-4-piperidinyl)amino]methyl]benzonitrile
IUPAC NAME: 4-chloro-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]benzonitrile
SYSTEMATIC NAME: 4-chloranyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C15H20ClN3
MOLECULAR WEIGHT: 277.7924
SMILES: CN1CCC(CC1)N(C)CC2=C(C=CC(=C2)Cl)C#N
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Product OPENEYE NAME: [4-(3-chlorophenoxy)-3-(methylaminomethyl)phenyl]-(4-cyclopropyl-1,4-diazepan-1-yl)methanone
CAS Name: [4-(3-chlorophenoxy)-3-(methylaminomethyl)phenyl]-(4-cyclopropyl-1,4-diazepan-1-yl)methanone
IUPAC NAME: [4-(3-chlorophenoxy)-3-(methylaminomethyl)phenyl]-(4-cyclopropyl-1,4-diazepan-1-yl)methanone
SYSTEMATIC NAME: [4-(3-chloranylphenoxy)-3-(methylaminomethyl)phenyl]-(4-cyclopropyl-1,4-diazepan-1-yl)methanone
MOLECULAR FORMULA: C23H28ClN3O2
MOLECULAR WEIGHT: 413.94032
SMILES: CNCC1=C(C=CC(=C1)C(=O)N2CCCN(CC2)C3CC3)OC4=CC(=CC=C4)Cl
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Product OPENEYE NAME: N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenyl-imidazol-2-yl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-N-(4-pyridylmethyl)acetamide
CAS Name: N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenyl-2-imidazolyl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-N-(pyridin-4-ylmethyl)acetamide
IUPAC NAME: N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenylimidazol-2-yl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-N-(pyridin-4-ylmethyl)acetamide
SYSTEMATIC NAME: N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenyl-imidazol-2-yl]ethyl]-2-[4-fluoranyl-3-(trifluoromethyl)phenyl]-N-(pyridin-4-ylmethyl)ethanamide
MOLECULAR FORMULA: C34H30F4N4O2
MOLECULAR WEIGHT: 602.621213
SMILES: CCOC1=CC=C(C=C1)N2C=C(N=C2[C@@H](C)N(CC3=CC=NC=C3)C(=O)CC4=CC(=C(C=C4)F)C(F)(F)F)C5=CC=CC=C5
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Product OPENEYE NAME: N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenyl-imidazol-2-yl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-N-(2-pyridylmethyl)acetamide
CAS Name: N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenyl-2-imidazolyl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-N-(2-pyridinylmethyl)acetamide
IUPAC NAME: N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenylimidazol-2-yl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-N-(pyridin-2-ylmethyl)acetamide
SYSTEMATIC NAME: N-[(1R)-1-[1-(4-ethoxyphenyl)-4-phenyl-imidazol-2-yl]ethyl]-2-[4-fluoranyl-3-(trifluoromethyl)phenyl]-N-(pyridin-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C34H30F4N4O2
MOLECULAR WEIGHT: 602.621213
SMILES: CCOC1=CC=C(C=C1)N2C=C(N=C2[C@@H](C)N(CC3=CC=CC=N3)C(=O)CC4=CC(=C(C=C4)F)C(F)(F)F)C5=CC=CC=C5
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Product OPENEYE NAME: N-[(1R)-1-[1-(4-cyanophenyl)-4-cyclopropyl-5-phenyl-imidazol-2-yl]ethyl]-N-(2-ethylsulfonylethyl)-2-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide
CAS Name: N-[(1R)-1-[1-(4-cyanophenyl)-4-cyclopropyl-5-phenyl-2-imidazolyl]ethyl]-N-(2-ethylsulfonylethyl)-2-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide
IUPAC NAME: N-[(1R)-1-[1-(4-cyanophenyl)-4-cyclopropyl-5-phenylimidazol-2-yl]ethyl]-N-(2-ethylsulfonylethyl)-2-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide
SYSTEMATIC NAME: N-[(1R)-1-[1-(4-cyanophenyl)-4-cyclopropyl-5-phenyl-imidazol-2-yl]ethyl]-N-(2-ethylsulfonylethyl)-2-[4-fluoranyl-3-(trifluoromethyl)phenyl]ethanamide
MOLECULAR FORMULA: C34H32F4N4O3S
MOLECULAR WEIGHT: 652.701493
SMILES: CCS(=O)(=O)CCN([C@H](C)C1=NC(=C(N1C2=CC=C(C=C2)C#N)C3=CC=CC=C3)C4CC4)C(=O)CC5=CC(=C(C=C5)F)C(F)(F)F
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Product OPENEYE NAME: (4S)-3-[(2S,3S)-3-[[(2S)-2-[[(2S,3S)-2-acetamido-3-methyl-pentanoyl]amino]-2-phenyl-acetyl]amino]-2-hydroxy-4-phenyl-butanoyl]-N-[(1S,2S)-1-[[(1S)-1-carbamoyl-3-methylsulfanyl-propyl]carbamoyl]-2-methyl-butyl]-5,5-dimethyl-thiazolidine-4-carboxamide
CAS Name: (4S)-3-[(2S,3S)-3-[[(2S)-2-[[(2S,3S)-2-acetamido-3-methyl-1-oxopentyl]amino]-1-oxo-2-phenylethyl]amino]-2-hydroxy-1-oxo-4-phenylbutyl]-N-[(2S,3S)-1-[[(2S)-1-amino-4-(methylthio)-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]-5,5-dimethyl-4-thiazolidine
IUPAC NAME: (4S)-3-[(2S,3S)-3-[[(2S)-2-[[(2S,3S)-2-acetamido-3-methylpentanoyl]amino]-2-phenylacetyl]amino]-2-hydroxy-4-phenylbutanoyl]-N-[(2S,3S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]-5,5-dimethyl-1,3-thiazolidine-4-carb
SYSTEMATIC NAME: (4S)-3-[(2S,3S)-3-[[(2S)-2-[[(2S,3S)-2-acetamido-3-methyl-pentanoyl]amino]-2-phenyl-ethanoyl]amino]-2-oxidanyl-4-phenyl-butanoyl]-N-[(2S,3S)-1-[[(2S)-1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-5,5-dim
MOLECULAR FORMULA: C43H63N7O8S2
MOLECULAR WEIGHT: 870.13242
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](C1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](C(=O)N3CSC([C@@H]3C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCSC)C(=O)N)(C)C)O)NC(=O)C
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Product OPENEYE NAME: (4S)-3-[(2S,3R)-3-[[(2S,3S)-2-[[(2S,3S)-2-acetamido-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-2-hydroxy-4-phenyl-butanoyl]-N-[(1S,2S)-1-[[(1S)-1-carbamoyl-3-methylsulfanyl-propyl]carbamoyl]-2-methyl-butyl]-5,5-dimethyl-thiazolidine-4-carboxamide
CAS Name: (4S)-3-[(2S,3R)-3-[[(2S,3S)-2-[[(2S,3S)-2-acetamido-3-methyl-1-oxopentyl]amino]-3-methyl-1-oxopentyl]amino]-2-hydroxy-1-oxo-4-phenylbutyl]-N-[(2S,3S)-1-[[(2S)-1-amino-4-(methylthio)-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]-5,5-dimethyl-4-thiazoli
IUPAC NAME: (4S)-3-[(2S,3R)-3-[[(2S,3S)-2-[[(2S,3S)-2-acetamido-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]-2-hydroxy-4-phenylbutanoyl]-N-[(2S,3S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]-5,5-dimethyl-1,3-thiazolidine-
SYSTEMATIC NAME: (4S)-3-[(2S,3R)-3-[[(2S,3S)-2-[[(2S,3S)-2-acetamido-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-2-oxidanyl-4-phenyl-butanoyl]-N-[(2S,3S)-1-[[(2S)-1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-5,5
MOLECULAR FORMULA: C41H67N7O8S2
MOLECULAR WEIGHT: 850.14278
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H](CC1=CC=CC=C1)[C@@H](C(=O)N2CSC([C@@H]2C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCSC)C(=O)N)(C)C)O)NC(=O)C
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Product OPENEYE NAME: 4-[[(4-chlorophenyl)sulfonyl-(7,7-dimethyl-2-oxo-azepan-3-yl)amino]methyl]-N-cyclopropyl-benzamide
CAS Name: 4-[[(4-chlorophenyl)sulfonyl-(7,7-dimethyl-2-oxo-3-azepanyl)amino]methyl]-N-cyclopropylbenzamide
IUPAC NAME: 4-[[(4-chlorophenyl)sulfonyl-(7,7-dimethyl-2-oxoazepan-3-yl)amino]methyl]-N-cyclopropylbenzamide
SYSTEMATIC NAME: 4-[[(4-chlorophenyl)sulfonyl-(7,7-dimethyl-2-oxidanylidene-azepan-3-yl)amino]methyl]-N-cyclopropyl-benzamide
MOLECULAR FORMULA: C25H30ClN3O4S
MOLECULAR WEIGHT: 504.0414
SMILES: CC1(CCCC(C(=O)N1)N(CC2=CC=C(C=C2)C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)C
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