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

Systemtic Name: N-[2-[[1-cyano-3-(4-methylpiperazin-1-yl)propyl]carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide Openeye Name: N-[2-[[1-cyano-3-(4-methylpiperazin-1-yl)propyl]carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide CAS Name: N-[2-[[[1-cyano-3-(4-methyl-1-piperazinyl)propyl]amino]-oxomethyl]cyclohexyl]-1-methyl-2-indolecarboxamide IUPAC Name: N-[2-[[1-cyano-3-(4-methylpiperazin-1-yl)propyl]carbamoyl]cyclohexyl]-1-methylindole-2-carboxamide Traditional Name: N-[2-[[1-cyano-3-(4-methylpiperazino)propyl]carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide Formula: C26H36N6O2 MolecularWeight: 464.60304

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC(C#N)NC(=O)C2CCCCC2NC(=O)C3=CC4=CC=CC=C4N3C

Isomeric SMILES

CN1CCN(CC1)CCC(C#N)NC(=O)C2CCCCC2NC(=O)C3=CC4=CC=CC=C4N3C

InChI

InChI=1S/C26H36N6O2/c1-30-13-15-32(16-14-30)12-11-20(18-27)28-25(33)21-8-4-5-9-22(21)29-26(34)24-17-19-7-3-6-10-23(19)31(24)2/h3,6-7,10,17,20-22H,4-5,8-9,11-16H2,1-2H3,(H,28,33)(H,29,34)