2-[3-azanylpropyl-(3-methylphenyl)amino]pyridine-3-carboxamide

Systemtic Name: 2-[3-azanylpropyl-(3-methylphenyl)amino]pyridine-3-carboxamide Openeye Name: 2-[N-(3-aminopropyl)-3-methyl-anilino]pyridine-3-carboxamide CAS Name: 2-[N-(3-aminopropyl)-3-methylanilino]-3-pyridinecarboxamide IUPAC Name: 2-[N-(3-aminopropyl)-3-methylanilino]pyridine-3-carboxamide Traditional Name: 2-[N-(3-aminopropyl)-3-methyl-anilino]nicotinamide Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCCN)C2=C(C=CC=N2)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)N(CCCN)C2=C(C=CC=N2)C(=O)N

InChI

InChI=1S/C16H20N4O/c1-12-5-2-6-13(11-12)20(10-4-8-17)16-14(15(18)21)7-3-9-19-16/h2-3,5-7,9,11H,4,8,10,17H2,1H3,(H2,18,21)