N-[2-(azepan-1-ylmethyl)-1-butyl-benzimidazol-5-yl]-3-methyl-benzamide

Systemtic Name: N-[2-(azepan-1-ylmethyl)-1-butyl-benzimidazol-5-yl]-3-methyl-benzamide Openeye Name: N-[2-(azepan-1-ylmethyl)-1-butyl-benzimidazol-5-yl]-3-methyl-benzamide CAS Name: N-[2-(1-azepanylmethyl)-1-butyl-5-benzimidazolyl]-3-methylbenzamide IUPAC Name: N-[2-(azepan-1-ylmethyl)-1-butylbenzimidazol-5-yl]-3-methylbenzamide Traditional Name: N-[2-(azepan-1-ylmethyl)-1-butyl-benzimidazol-5-yl]-3-methyl-benzamide Formula: C26H34N4O MolecularWeight: 418.57436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)C)N=C1CN4CCCCCC4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)C)N=C1CN4CCCCCC4

InChI

InChI=1S/C26H34N4O/c1-3-4-16-30-24-13-12-22(27-26(31)21-11-9-10-20(2)17-21)18-23(24)28-25(30)19-29-14-7-5-6-8-15-29/h9-13,17-18H,3-8,14-16,19H2,1-2H3,(H,27,31)