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

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-1-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxo-pyridine-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-1-methyl-N-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]-2-oxo-3-pyridinecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-1-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxopyridine-3-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-2-keto-1-methyl-N-[4-[(4-methylpiperazino)methyl]phenyl]nicotinamide Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC(=CN(C3=O)C)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC(=CN(C3=O)C)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H28N4O4/c1-28-9-11-30(12-10-28)15-18-3-6-21(7-4-18)27-25(31)22-13-20(16-29(2)26(22)32)19-5-8-23-24(14-19)34-17-33-23/h3-8,13-14,16H,9-12,15,17H2,1-2H3,(H,27,31)