N-(4-butoxyphenyl)-4-[1-(phenylmethyl)benzimidazol-2-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-butoxyphenyl)-4-[1-(phenylmethyl)benzimidazol-2-yl]piperazine-1-carboxamide Openeye Name: 4-(1-benzylbenzimidazol-2-yl)-N-(4-butoxyphenyl)piperazine-1-carboxamide CAS Name: N-(4-butoxyphenyl)-4-[1-(phenylmethyl)-2-benzimidazolyl]-1-piperazinecarboxamide IUPAC Name: 4-(1-benzylbenzimidazol-2-yl)-N-(4-butoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(1-benzylbenzimidazol-2-yl)-N-(4-butoxyphenyl)piperazine-1-carboxamide Formula: C29H33N5O2 MolecularWeight: 483.60462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5

InChI

InChI=1S/C29H33N5O2/c1-2-3-21-36-25-15-13-24(14-16-25)30-29(35)33-19-17-32(18-20-33)28-31-26-11-7-8-12-27(26)34(28)22-23-9-5-4-6-10-23/h4-16H,2-3,17-22H2,1H3,(H,30,35)