2-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide CAS Name: 2-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-(1,4-diazepan-1-yl)-N-(2,5-dimethoxybenzyl)nicotinamide Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC(=O)C2=C(N=CC=C2)N3CCCNCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC(=O)C2=C(N=CC=C2)N3CCCNCC3

InChI

InChI=1S/C20H26N4O3/c1-26-16-6-7-18(27-2)15(13-16)14-23-20(25)17-5-3-9-22-19(17)24-11-4-8-21-10-12-24/h3,5-7,9,13,21H,4,8,10-12,14H2,1-2H3,(H,23,25)