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

Systemtic Name: N-[1-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]ethyl]-3-phenyl-propanamide Openeye Name: N-[1-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]ethyl]-3-phenyl-propanamide CAS Name: N-[1-[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]ethyl]-3-phenylpropanamide IUPAC Name: N-[1-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]-3-phenylpropanamide Traditional Name: N-[1-[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]ethyl]-3-phenyl-propionamide Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1CC(=O)N3CCCCCC3)NC(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2N1CC(=O)N3CCCCCC3)NC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2/c1-20(27-24(31)16-15-21-11-5-4-6-12-21)26-28-22-13-7-8-14-23(22)30(26)19-25(32)29-17-9-2-3-10-18-29/h4-8,11-14,20H,2-3,9-10,15-19H2,1H3,(H,27,31)