N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1-pyrrol-1-yl-cyclohexane-1-carboxamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1-pyrrol-1-yl-cyclohexane-1-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-1-pyrrol-1-yl-cyclohexanecarboxamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-1-(1-pyrrolyl)-1-cyclohexanecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-1-pyrrol-1-ylcyclohexane-1-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-1-pyrrol-1-yl-cyclohexanecarboxamide Formula: C24H34N4O MolecularWeight: 394.55296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCCN2CCN(CC2)CC3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

C1CCC(CC1)(C(=O)NCCN2CCN(CC2)CC3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C24H34N4O/c29-23(24(11-5-2-6-12-24)28-14-7-8-15-28)25-13-16-26-17-19-27(20-18-26)21-22-9-3-1-4-10-22/h1,3-4,7-10,14-15H,2,5-6,11-13,16-21H2,(H,25,29)