N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-[2-(4-methylpiperazin-1-yl)ethyl]indole-2-carboxamide

Systemtic Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-[2-(4-methylpiperazin-1-yl)ethyl]indole-2-carboxamide Openeye Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-[2-(4-methylpiperazin-1-yl)ethyl]indole-2-carboxamide CAS Name: N-[2-[[(1-cyano-3-methylbutyl)amino]-oxomethyl]cyclohexyl]-1-[2-(4-methyl-1-piperazinyl)ethyl]-2-indolecarboxamide IUPAC Name: N-[2-[(1-cyano-3-methylbutyl)carbamoyl]cyclohexyl]-1-[2-(4-methylpiperazin-1-yl)ethyl]indole-2-carboxamide Traditional Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-[2-(4-methylpiperazino)ethyl]indole-2-carboxamide Formula: C29H42N6O2 MolecularWeight: 506.68278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC3=CC=CC=C3N2CCN4CCN(CC4)C

Isomeric SMILES

CC(C)CC(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC3=CC=CC=C3N2CCN4CCN(CC4)C

InChI

InChI=1S/C29H42N6O2/c1-21(2)18-23(20-30)31-28(36)24-9-5-6-10-25(24)32-29(37)27-19-22-8-4-7-11-26(22)35(27)17-16-34-14-12-33(3)13-15-34/h4,7-8,11,19,21,23-25H,5-6,9-10,12-18H2,1-3H3,(H,31,36)(H,32,37)