6-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 6-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide Openeye Name: 6-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide CAS Name: 6-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 6-(1,4-diazepan-1-yl)-N-[(2,5-dimethoxyphenyl)methyl]pyridine-3-carboxamide Traditional Name: 6-(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=CN=C(C=C2)N3CCCNCC3

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O3/c1-26-17-5-6-18(27-2)16(12-17)14-23-20(25)15-4-7-19(22-13-15)24-10-3-8-21-9-11-24/h4-7,12-13,21H,3,8-11,14H2,1-2H3,(H,23,25)