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

Systemtic Name: N-[[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]methyl]-N-methyl-pyridine-3-carboxamide Openeye Name: N-[[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]methyl]-N-methyl-pyridine-3-carboxamide CAS Name: N-[[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]methyl]-N-methyl-3-pyridinecarboxamide IUPAC Name: N-[[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]methyl]-N-methylpyridine-3-carboxamide Traditional Name: N-[[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]methyl]-N-methyl-nicotinamide Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2N1CCC(=O)N3CCCCCC3)C(=O)C4=CN=CC=C4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2N1CCC(=O)N3CCCCCC3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C24H29N5O2/c1-27(24(31)19-9-8-13-25-17-19)18-22-26-20-10-4-5-11-21(20)29(22)16-12-23(30)28-14-6-2-3-7-15-28/h4-5,8-11,13,17H,2-3,6-7,12,14-16,18H2,1H3