N-[2-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-3-phenyl-propanamide

Systemtic Name: N-[2-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-3-phenyl-propanamide Openeye Name: N-[2-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]ethyl]-3-phenyl-propanamide CAS Name: N-[2-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]ethyl]-3-phenylpropanamide IUPAC Name: N-[2-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]ethyl]-3-phenylpropanamide Traditional Name: N-[2-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]ethyl]-3-phenyl-propionamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCN2C3=CC=CC=C3N=C2CCNC(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)CCN2C3=CC=CC=C3N=C2CCNC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O2/c32-26(15-14-22-10-4-3-5-11-22)28-18-16-25-29-23-12-6-7-13-24(23)31(25)21-17-27(33)30-19-8-1-2-9-20-30/h3-7,10-13H,1-2,8-9,14-21H2,(H,28,32)