2-[4-(1H-indol-3-yl)cyclohexyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(1H-indol-3-yl)cyclohexyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(1H-indol-3-yl)cyclohexyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[4-(1H-indol-3-yl)cyclohexyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-(1H-indol-3-yl)cyclohexyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(1H-indol-3-yl)cyclohexyl]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C24H29N5O MolecularWeight: 403.51996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC(=O)N2CCN(CC2)C3=NC=CC=N3)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CC(CCC1CC(=O)N2CCN(CC2)C3=NC=CC=N3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C24H29N5O/c30-23(28-12-14-29(15-13-28)24-25-10-3-11-26-24)16-18-6-8-19(9-7-18)21-17-27-22-5-2-1-4-20(21)22/h1-5,10-11,17-19,27H,6-9,12-16H2