N-[1-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[1-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide Openeye Name: N-[1-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide CAS Name: N-[1-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]ethyl]-2,4-dimethylbenzamide IUPAC Name: N-[1-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]ethyl]-2,4-dimethylbenzamide Traditional Name: N-[1-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]ethyl]-2,4-dimethyl-benzamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(C)C2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(C)C2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)C

InChI

InChI=1S/C27H34N4O2/c1-19-12-13-22(20(2)18-19)27(33)28-21(3)26-29-23-10-6-7-11-24(23)31(26)17-14-25(32)30-15-8-4-5-9-16-30/h6-7,10-13,18,21H,4-5,8-9,14-17H2,1-3H3,(H,28,33)