4-[methyl(phenethyl)amino]-N-[3-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: 4-[methyl(phenethyl)amino]-N-[3-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: 4-[methyl(phenethyl)amino]-N-[3-(4-methylpiperazin-1-yl)phenyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: 4-[methyl(phenethyl)amino]-N-[3-(4-methyl-1-piperazinyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: 4-[methyl(phenethyl)amino]-N-[3-(4-methylpiperazin-1-yl)phenyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: 2-keto-4-[methyl(phenethyl)amino]-N-[3-(4-methylpiperazino)phenyl]-1H-pyridine-3-carboxamide Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=CC=C2)NC(=O)C3=C(C=CNC3=O)N(C)CCC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=CC(=CC=C2)NC(=O)C3=C(C=CNC3=O)N(C)CCC4=CC=CC=C4

InChI

InChI=1S/C26H31N5O2/c1-29-15-17-31(18-16-29)22-10-6-9-21(19-22)28-26(33)24-23(11-13-27-25(24)32)30(2)14-12-20-7-4-3-5-8-20/h3-11,13,19H,12,14-18H2,1-2H3,(H,27,32)(H,28,33)