2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(4-methyl-1-piperazinyl)propyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclohexyl-1-keto-3-(4-methoxyphenyl)-N-[3-(4-methylpiperazino)propyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C31H42N4O3 MolecularWeight: 518.69018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CCCCC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CCCCC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C31H42N4O3/c1-33-19-21-34(22-20-33)18-8-17-32-30(36)28-26-11-6-7-12-27(26)31(37)35(24-9-4-3-5-10-24)29(28)23-13-15-25(38-2)16-14-23/h6-7,11-16,24,28-29H,3-5,8-10,17-22H2,1-2H3,(H,32,36)