2-[(2-methoxyphenyl)amino]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-[(2-methoxyphenyl)amino]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide Openeye Name: 2-(2-methoxyanilino)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]pyridine-3-carboxamide CAS Name: 2-(2-methoxyanilino)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-3-pyridinecarboxamide IUPAC Name: 2-(2-methoxyanilino)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-2-(o-anisidino)nicotinamide Formula: C22H22N6O3 MolecularWeight: 418.44848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=C(C=CC=N2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

COC1=CC=CC=C1NC2=C(C=CC=N2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C22H22N6O3/c1-31-18-7-3-2-6-17(18)27-21-16(5-4-10-24-21)22(30)26-15-8-9-19(25-13-15)28-12-11-23-20(29)14-28/h2-10,13H,11-12,14H2,1H3,(H,23,29)(H,24,27)(H,26,30)