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

Systemtic Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-4-(phenethylamino)-1H-pyridine-3-carboxamide Openeye Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2-oxo-4-(phenethylamino)-1H-pyridine-3-carboxamide CAS Name: N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]-2-oxo-4-(phenethylamino)-1H-pyridine-3-carboxamide IUPAC Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2-oxo-4-(phenethylamino)-1H-pyridine-3-carboxamide Traditional Name: 2-keto-N-[4-methoxy-3-(4-methylpiperazino)phenyl]-4-(phenethylamino)-1H-pyridine-3-carboxamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)C3=C(C=CNC3=O)NCCC4=CC=CC=C4)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)C3=C(C=CNC3=O)NCCC4=CC=CC=C4)OC

InChI

InChI=1S/C26H31N5O3/c1-30-14-16-31(17-15-30)22-18-20(8-9-23(22)34-2)29-26(33)24-21(11-13-28-25(24)32)27-12-10-19-6-4-3-5-7-19/h3-9,11,13,18H,10,12,14-17H2,1-2H3,(H,29,33)(H2,27,28,32)