5-(1,3-benzodioxol-5-yl)-N-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-N-[2-[(4-methyl-1-piperazinyl)methyl]phenyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-2-keto-N-[2-[(4-methylpiperazino)methyl]phenyl]-1H-pyridine-3-carboxamide Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=CC=C2NC(=O)C3=CC(=CNC3=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1CCN(CC1)CC2=CC=CC=C2NC(=O)C3=CC(=CNC3=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H26N4O4/c1-28-8-10-29(11-9-28)15-18-4-2-3-5-21(18)27-25(31)20-12-19(14-26-24(20)30)17-6-7-22-23(13-17)33-16-32-22/h2-7,12-14H,8-11,15-16H2,1H3,(H,26,30)(H,27,31)