N-[5-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[5-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide Openeye Name: N-[5-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide CAS Name: N-[5-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]pentyl]-3,4-dimethoxybenzamide IUPAC Name: N-[5-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxybenzamide Traditional Name: N-[5-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]pentyl]-3,4-dimethoxy-benzamide Formula: C30H40N4O4 MolecularWeight: 520.663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCCCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCCCCC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4)OC

InChI

InChI=1S/C30H40N4O4/c1-37-26-16-15-23(22-27(26)38-2)30(36)31-18-9-5-6-14-28-32-24-12-7-8-13-25(24)34(28)21-17-29(35)33-19-10-3-4-11-20-33/h7-8,12-13,15-16,22H,3-6,9-11,14,17-21H2,1-2H3,(H,31,36)