N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-(piperidin-4-ylmethyl)indole-2-carboxamide

Systemtic Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-(piperidin-4-ylmethyl)indole-2-carboxamide Openeye Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-(4-piperidylmethyl)indole-2-carboxamide CAS Name: N-[2-[[(1-cyano-3-methylbutyl)amino]-oxomethyl]cyclohexyl]-1-(4-piperidinylmethyl)-2-indolecarboxamide IUPAC Name: N-[2-[(1-cyano-3-methylbutyl)carbamoyl]cyclohexyl]-1-(piperidin-4-ylmethyl)indole-2-carboxamide Traditional Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-(4-piperidylmethyl)indole-2-carboxamide Formula: C28H39N5O2 MolecularWeight: 477.64156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC3=CC=CC=C3N2CC4CCNCC4

Isomeric SMILES

CC(C)CC(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC3=CC=CC=C3N2CC4CCNCC4

InChI

InChI=1S/C28H39N5O2/c1-19(2)15-22(17-29)31-27(34)23-8-4-5-9-24(23)32-28(35)26-16-21-7-3-6-10-25(21)33(26)18-20-11-13-30-14-12-20/h3,6-7,10,16,19-20,22-24,30H,4-5,8-9,11-15,18H2,1-2H3,(H,31,34)(H,32,35)