N-[[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]methyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]methyl]-2,4-dimethyl-benzamide Openeye Name: N-[[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]methyl]-2,4-dimethyl-benzamide CAS Name: N-[[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]methyl]-2,4-dimethylbenzamide IUPAC Name: N-[[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]methyl]-2,4-dimethylbenzamide Traditional Name: N-[[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]methyl]-2,4-dimethyl-benzamide Formula: C25H30N4O2 MolecularWeight: 418.5313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4)C

InChI

InChI=1S/C25H30N4O2/c1-18-11-12-20(19(2)15-18)25(31)26-16-23-27-21-9-5-6-10-22(21)29(23)17-24(30)28-13-7-3-4-8-14-28/h5-6,9-12,15H,3-4,7-8,13-14,16-17H2,1-2H3,(H,26,31)