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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C(=O)NC=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C)C4=CC=CC=C4

Isomeric SMILES

CC(CNC1=C(C(=O)NC=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C)C4=CC=CC=C4

InChI

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