N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(phenylcarbonyl)piperidin-1-yl]ethanamide

Systemtic Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(phenylcarbonyl)piperidin-1-yl]ethanamide Openeye Name: 2-(4-benzoyl-1-piperidyl)-N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)acetamide CAS Name: 2-(4-benzoyl-1-piperidinyl)-N-(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)acetamide IUPAC Name: 2-(4-benzoylpiperidin-1-yl)-N-(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)acetamide Traditional Name: 2-(4-benzoylpiperidino)-N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)acetamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCC(CC2)C(=O)C3=CC=CC=C3)C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCC(CC2)C(=O)C3=CC=CC=C3)C4CCCCC4)C

InChI

InChI=1S/C27H34N4O2/c1-19-20(2)31(23-11-7-4-8-12-23)27(24(19)17-28)29-25(32)18-30-15-13-22(14-16-30)26(33)21-9-5-3-6-10-21/h3,5-6,9-10,22-23H,4,7-8,11-16,18H2,1-2H3,(H,29,32)