Product OPENEYE NAME: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester
IUPAC NAME: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H22N2O5
MOLECULAR WEIGHT: 346.37768
SMILES: CC(C)CCNC(=O)NC(=O)COC(=O)C1=CC2=CC=CC=C2OC1
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Product OPENEYE NAME: N-(4-fluorophenyl)-1-phenyl-cyclopropanecarboxamide
CAS Name: N-(4-fluorophenyl)-1-phenyl-1-cyclopropanecarboxamide
IUPAC NAME: N-(4-fluorophenyl)-1-phenylcyclopropane-1-carboxamide
SYSTEMATIC NAME: N-(4-fluorophenyl)-1-phenyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C16H14FNO
MOLECULAR WEIGHT: 255.286863
SMILES: C1CC1(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F
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Product OPENEYE NAME: 2-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]piperazine-1,4-diium-1-yl]-N-(2,6-dimethylphenyl)acetamide
CAS Name: 2-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1-piperazine-1,4-diiumyl]-N-(2,6-dimethylphenyl)acetamide
IUPAC NAME: 2-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]piperazine-1,4-diium-1-yl]-N-(2,6-dimethylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]piperazine-1,4-diium-1-yl]-N-(2,6-dimethylphenyl)ethanamide
MOLECULAR FORMULA: C25H34N4O2+2
MOLECULAR WEIGHT: 422.56306
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)N3CCC4=CC=CC=C4C3
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Product OPENEYE NAME: 2-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide
CAS Name: 2-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1-piperazinyl]-N-(2,6-dimethylphenyl)acetamide
IUPAC NAME: 2-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)ethanamide
MOLECULAR FORMULA: C25H32N4O2
MOLECULAR WEIGHT: 420.54718
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)N3CCC4=CC=CC=C4C3
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-sulfamoyl-benzamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-methoxy-5-sulfamoylbenzamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-sulfamoylbenzamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-sulfamoyl-benzamide
MOLECULAR FORMULA: C17H19FN2O4S2
MOLECULAR WEIGHT: 398.472163
SMILES: COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide
CAS Name: (2R)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]propanamide
IUPAC NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide
SYSTEMATIC NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide
MOLECULAR FORMULA: C15H24N3O3S+
MOLECULAR WEIGHT: 326.43436
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)[C@H](C)C(=O)N
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Product OPENEYE NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide
CAS Name: (2R)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]propanamide
IUPAC NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide
SYSTEMATIC NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide
MOLECULAR FORMULA: C15H23N3O3S
MOLECULAR WEIGHT: 325.42642
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)[C@H](C)C(=O)N
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Product OPENEYE NAME: [(1R)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 3-(methylsulfamoyl)benzoate
CAS Name: 3-(methylsulfamoyl)benzoic 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] 3-(methylsulfamoyl)benzoate
SYSTEMATIC NAME: [(2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 3-(methylsulfamoyl)benzoate
MOLECULAR FORMULA: C19H22N2O6S
MOLECULAR WEIGHT: 406.45278
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@@H](C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)NC
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C20H32N4O2+2
MOLECULAR WEIGHT: 360.49368
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)N3CCCC3
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H30N4O2
MOLECULAR WEIGHT: 358.4778
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)N3CCCC3
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Product OPENEYE NAME: (2-benzamido-2-oxo-ethyl) 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid (2-benzamido-2-oxoethyl) ester
IUPAC NAME: (2-benzamido-2-oxoethyl) 2H-chromene-3-carboxylate
SYSTEMATIC NAME: (2-benzamido-2-oxidanylidene-ethyl) 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C19H15NO5
MOLECULAR WEIGHT: 337.3261
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: N-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide
CAS Name: N-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-methyl-5-thieno[2,3-c]pyrazolecarboxamide
IUPAC NAME: N-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-methylthieno[2,3-c]pyrazole-5-carboxamide
SYSTEMATIC NAME: N-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide
MOLECULAR FORMULA: C20H15F2N3OS
MOLECULAR WEIGHT: 383.414406
SMILES: CC1=NN(C2=C1C=C(S2)C(=O)NC3=CC=C(C=C3)F)CC4=CC=C(C=C4)F
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Product OPENEYE NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
CAS Name: (2S)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]propanenitrile
IUPAC NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
SYSTEMATIC NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
MOLECULAR FORMULA: C15H22N3O2S+
MOLECULAR WEIGHT: 308.41908
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)[C@@H](C)C#N
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Product OPENEYE NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanenitrile
CAS Name: (2S)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]propanenitrile
IUPAC NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanenitrile
SYSTEMATIC NAME: (2S)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanenitrile
MOLECULAR FORMULA: C15H21N3O2S
MOLECULAR WEIGHT: 307.41114
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)[C@@H](C)C#N
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C22H36N4O2+2
MOLECULAR WEIGHT: 388.54684
SMILES: CC1CCN(CC1)C(=O)C[NH+]2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C22H34N4O2
MOLECULAR WEIGHT: 386.53096
SMILES: CC1CCN(CC1)C(=O)CN2CCN(CC2)CC(=O)NC3=C(C=CC=C3C)C
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Product OPENEYE NAME: [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 3-(methylsulfamoyl)benzoate
CAS Name: 3-(methylsulfamoyl)benzoic acid [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 3-(methylsulfamoyl)benzoate
SYSTEMATIC NAME: [(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 3-(methylsulfamoyl)benzoate
MOLECULAR FORMULA: C19H22N2O6S
MOLECULAR WEIGHT: 406.45278
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@H](C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)NC
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Product OPENEYE NAME: 2-chloro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-(methylsulfamoyl)benzamide
CAS Name: 2-chloro-N-[2-[(2-fluorophenyl)methylthio]ethyl]-5-(methylsulfamoyl)benzamide
IUPAC NAME: 2-chloro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-(methylsulfamoyl)benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-(methylsulfamoyl)benzamide
MOLECULAR FORMULA: C17H18ClFN2O3S2
MOLECULAR WEIGHT: 416.917823
SMILES: CNS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: 2-(4-methoxyphenoxy)ethyl 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid 2-(4-methoxyphenoxy)ethyl ester
IUPAC NAME: 2-(4-methoxyphenoxy)ethyl 2H-chromene-3-carboxylate
SYSTEMATIC NAME: 2-(4-methoxyphenoxy)ethyl 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C19H18O5
MOLECULAR WEIGHT: 326.34322
SMILES: COC1=CC=C(C=C1)OCCOC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C21H34N4O2+2
MOLECULAR WEIGHT: 374.52026
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)N3CCCCC3
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C21H32N4O2
MOLECULAR WEIGHT: 372.50438
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)N3CCCCC3
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Product OPENEYE NAME: [2-oxo-2-(2-oxooxazolidin-3-yl)ethyl] 3-(methylsulfamoyl)benzoate
CAS Name: 3-(methylsulfamoyl)benzoic acid [2-oxo-2-(2-oxo-3-oxazolidinyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 3-(methylsulfamoyl)benzoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2-oxidanylidene-1,3-oxazolidin-3-yl)ethyl] 3-(methylsulfamoyl)benzoate
MOLECULAR FORMULA: C13H14N2O7S
MOLECULAR WEIGHT: 342.32446
SMILES: CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)N2CCOC2=O
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Product OPENEYE NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
CAS Name: (2R)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]propanenitrile
IUPAC NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
SYSTEMATIC NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
MOLECULAR FORMULA: C15H22N3O2S+
MOLECULAR WEIGHT: 308.41908
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)[C@H](C)C#N
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Product OPENEYE NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanenitrile
CAS Name: (2R)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]propanenitrile
IUPAC NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanenitrile
SYSTEMATIC NAME: (2R)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]propanenitrile
MOLECULAR FORMULA: C15H21N3O2S
MOLECULAR WEIGHT: 307.41114
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)[C@H](C)C#N
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