N-[2-(azepan-1-ylmethyl)-1-propan-2-yl-benzimidazol-5-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[2-(azepan-1-ylmethyl)-1-propan-2-yl-benzimidazol-5-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-(azepan-1-ylmethyl)-1-isopropyl-benzimidazol-5-yl]-3,4-dimethoxy-benzamide CAS Name: N-[2-(1-azepanylmethyl)-1-propan-2-yl-5-benzimidazolyl]-3,4-dimethoxybenzamide IUPAC Name: N-[2-(azepan-1-ylmethyl)-1-propan-2-ylbenzimidazol-5-yl]-3,4-dimethoxybenzamide Traditional Name: N-[2-(azepan-1-ylmethyl)-1-isopropyl-benzimidazol-5-yl]-3,4-dimethoxy-benzamide Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC)N=C1CN4CCCCCC4

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC)N=C1CN4CCCCCC4

InChI

InChI=1S/C26H34N4O3/c1-18(2)30-22-11-10-20(27-26(31)19-9-12-23(32-3)24(15-19)33-4)16-21(22)28-25(30)17-29-13-7-5-6-8-14-29/h9-12,15-16,18H,5-8,13-14,17H2,1-4H3,(H,27,31)