N-[2-[[1-cyano-2-(4-methylphenyl)ethyl]carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide

Systemtic Name: N-[2-[[1-cyano-2-(4-methylphenyl)ethyl]carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide Openeye Name: N-[2-[[1-cyano-2-(p-tolyl)ethyl]carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide CAS Name: N-[2-[[[1-cyano-2-(4-methylphenyl)ethyl]amino]-oxomethyl]cyclohexyl]-1-methyl-2-indolecarboxamide IUPAC Name: N-[2-[[1-cyano-2-(4-methylphenyl)ethyl]carbamoyl]cyclohexyl]-1-methylindole-2-carboxamide Traditional Name: N-[2-[[1-cyano-2-(p-tolyl)ethyl]carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)NC(=O)C2CCCCC2NC(=O)C3=CC4=CC=CC=C4N3C

Isomeric SMILES

CC1=CC=C(C=C1)CC(C#N)NC(=O)C2CCCCC2NC(=O)C3=CC4=CC=CC=C4N3C

InChI

InChI=1S/C27H30N4O2/c1-18-11-13-19(14-12-18)15-21(17-28)29-26(32)22-8-4-5-9-23(22)30-27(33)25-16-20-7-3-6-10-24(20)31(25)2/h3,6-7,10-14,16,21-23H,4-5,8-9,15H2,1-2H3,(H,29,32)(H,30,33)