N-[4-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-4-(pyridin-2-ylmethylamino)-1H-pyridine-3-carboxamide

Systemtic Name: N-[4-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-4-(pyridin-2-ylmethylamino)-1H-pyridine-3-carboxamide Openeye Name: N-[4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-4-(2-pyridylmethylamino)-1H-pyridine-3-carboxamide CAS Name: N-[4-(4-methyl-1-piperazinyl)phenyl]-2-oxo-4-(2-pyridinylmethylamino)-1H-pyridine-3-carboxamide IUPAC Name: N-[4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-4-(pyridin-2-ylmethylamino)-1H-pyridine-3-carboxamide Traditional Name: 2-keto-N-[4-(4-methylpiperazino)phenyl]-4-(2-pyridylmethylamino)-1H-pyridine-3-carboxamide Formula: C23H26N6O2 MolecularWeight: 418.49154

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=CNC3=O)NCC4=CC=CC=N4

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=CNC3=O)NCC4=CC=CC=N4

InChI

InChI=1S/C23H26N6O2/c1-28-12-14-29(15-13-28)19-7-5-17(6-8-19)27-23(31)21-20(9-11-25-22(21)30)26-16-18-4-2-3-10-24-18/h2-11H,12-16H2,1H3,(H,27,31)(H2,25,26,30)