N-[[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]methyl]-N-methyl-pyridine-3-carboxamide

Systemtic Name: N-[[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]methyl]-N-methyl-pyridine-3-carboxamide Openeye Name: N-[[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]methyl]-N-methyl-pyridine-3-carboxamide CAS Name: N-[[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]methyl]-N-methyl-3-pyridinecarboxamide IUPAC Name: N-[[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]methyl]-N-methylpyridine-3-carboxamide Traditional Name: N-[[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]methyl]-N-methyl-nicotinamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2N1CC(=O)N3CCCCCC3)C(=O)C4=CN=CC=C4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2N1CC(=O)N3CCCCCC3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H27N5O2/c1-26(23(30)18-9-8-12-24-15-18)16-21-25-19-10-4-5-11-20(19)28(21)17-22(29)27-13-6-2-3-7-14-27/h4-5,8-12,15H,2-3,6-7,13-14,16-17H2,1H3