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

Systemtic Name: N-[2-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]ethyl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]ethyl]-3,4-dimethoxy-benzamide CAS Name: N-[2-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]ethyl]-3,4-dimethoxybenzamide IUPAC Name: N-[2-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]ethyl]-3,4-dimethoxybenzamide Traditional Name: N-[2-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]ethyl]-3,4-dimethoxy-benzamide Formula: C27H34N4O4 MolecularWeight: 478.58326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)OC

InChI

InChI=1S/C27H34N4O4/c1-34-23-12-11-20(19-24(23)35-2)27(33)28-15-13-25-29-21-9-5-6-10-22(21)31(25)18-14-26(32)30-16-7-3-4-8-17-30/h5-6,9-12,19H,3-4,7-8,13-18H2,1-2H3,(H,28,33)