Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxo-4-(2-thienyl)butanamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-oxo-4-thiophen-2-ylbutanamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxo-4-thiophen-2-ylbutanamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide
MOLECULAR FORMULA: C17H18FNO2S2
MOLECULAR WEIGHT: 351.458723
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)CCC(=O)C2=CC=CS2)F
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(4-methoxyphenoxy)acetate
CAS Name: 2-(4-methoxyphenoxy)acetic acid [(2R)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(4-methoxyphenoxy)acetate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(4-methoxyphenoxy)ethanoate
MOLECULAR FORMULA: C18H23N3O5
MOLECULAR WEIGHT: 361.39232
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@@H](C)OC(=O)COC2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-3-methylsulfanyl-propyl]-3-nitro-benzamide
CAS Name: N-[(2S)-1-(3,4-dimethylanilino)-4-(methylthio)-1-oxobutan-2-yl]-3-nitrobenzamide
IUPAC NAME: N-[(2S)-1-(3,4-dimethylanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-nitrobenzamide
SYSTEMATIC NAME: N-[(2S)-1-[(3,4-dimethylphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide
MOLECULAR FORMULA: C20H23N3O4S
MOLECULAR WEIGHT: 401.47932
SMILES: CC1=C(C=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(3-chlorophenyl)ethyl]acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-[(1R)-1-(3-chlorophenyl)ethyl]acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(3-chlorophenyl)ethyl]acetamide
SYSTEMATIC NAME: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C20H25ClN3O3S+
MOLECULAR WEIGHT: 422.9488
SMILES: C[C@H](C1=CC(=CC=C1)Cl)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(1R)-1-(3-chlorophenyl)ethyl]acetamide
CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(1R)-1-(3-chlorophenyl)ethyl]acetamide
IUPAC NAME: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(1R)-1-(3-chlorophenyl)ethyl]acetamide
SYSTEMATIC NAME: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H24ClN3O3S
MOLECULAR WEIGHT: 421.94086
SMILES: C[C@H](C1=CC(=CC=C1)Cl)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [2-[(3-methoxyphenyl)methylamino]-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] ester
IUPAC NAME: [2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[(3-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H19NO5
MOLECULAR WEIGHT: 353.36856
SMILES: COC1=CC=CC(=C1)CNC(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(4-methoxyphenoxy)acetate
CAS Name: 2-(4-methoxyphenoxy)acetic acid [(2S)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(4-methoxyphenoxy)acetate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(4-methoxyphenoxy)ethanoate
MOLECULAR FORMULA: C18H23N3O5
MOLECULAR WEIGHT: 361.39232
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@H](C)OC(=O)COC2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]quinoline-2-carboxamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-quinolinecarboxamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]quinoline-2-carboxamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]quinoline-2-carboxamide
MOLECULAR FORMULA: C19H17FN2OS
MOLECULAR WEIGHT: 340.414483
SMILES: C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCCSCC3=CC=CC=C3F
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Product OPENEYE NAME: (5S,7R)-N-(3,4-dimethylphenyl)-3-hydroxy-adamantane-1-carboxamide
CAS Name: (5S,7R)-N-(3,4-dimethylphenyl)-3-hydroxy-1-adamantanecarboxamide
IUPAC NAME: (5S,7R)-N-(3,4-dimethylphenyl)-3-hydroxyadamantane-1-carboxamide
SYSTEMATIC NAME: (5S,7R)-N-(3,4-dimethylphenyl)-3-oxidanyl-adamantane-1-carboxamide
MOLECULAR FORMULA: C19H25NO2
MOLECULAR WEIGHT: 299.4073
SMILES: CC1=C(C=C(C=C1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)O)C
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Product OPENEYE NAME: [(1R)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 2-(4-methoxyphenoxy)acetate
CAS Name: 2-(4-methoxyphenoxy)acetic acid [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 2-(4-methoxyphenoxy)acetate
SYSTEMATIC NAME: [(2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-(4-methoxyphenoxy)ethanoate
MOLECULAR FORMULA: C20H23NO6
MOLECULAR WEIGHT: 373.39972
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@@H](C)OC(=O)COC2=CC=C(C=C2)OC
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Product OPENEYE NAME: 5-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
CAS Name: 5-[[4-(benzenesulfonyl)-1-piperazin-1-iumyl]methyl]-3-phenyl-1,2,4-oxadiazole
IUPAC NAME: 5-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-phenyl-5-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C19H21N4O3S+
MOLECULAR WEIGHT: 385.46004
SMILES: C1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4
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