N-[2-methyl-6-(4-methylpiperazin-1-yl)-4-oxidanylidene-3-phenyl-quinazolin-5-yl]-2-piperidin-1-yl-pyridine-4-carboxamide

Systemtic Name: N-[2-methyl-6-(4-methylpiperazin-1-yl)-4-oxidanylidene-3-phenyl-quinazolin-5-yl]-2-piperidin-1-yl-pyridine-4-carboxamide Openeye Name: N-[2-methyl-6-(4-methylpiperazin-1-yl)-4-oxo-3-phenyl-quinazolin-5-yl]-2-(1-piperidyl)pyridine-4-carboxamide CAS Name: N-[2-methyl-6-(4-methyl-1-piperazinyl)-4-oxo-3-phenyl-5-quinazolinyl]-2-(1-piperidinyl)-4-pyridinecarboxamide IUPAC Name: N-[2-methyl-6-(4-methylpiperazin-1-yl)-4-oxo-3-phenylquinazolin-5-yl]-2-piperidin-1-ylpyridine-4-carboxamide Traditional Name: N-[4-keto-2-methyl-6-(4-methylpiperazino)-3-phenyl-quinazolin-5-yl]-2-piperidino-isonicotinamide Formula: C31H35N7O2 MolecularWeight: 537.6553

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C(C=C2)N3CCN(CC3)C)NC(=O)C4=CC(=NC=C4)N5CCCCC5)C(=O)N1C6=CC=CC=C6

Isomeric SMILES

CC1=NC2=C(C(=C(C=C2)N3CCN(CC3)C)NC(=O)C4=CC(=NC=C4)N5CCCCC5)C(=O)N1C6=CC=CC=C6

InChI

InChI=1S/C31H35N7O2/c1-22-33-25-11-12-26(36-19-17-35(2)18-20-36)29(28(25)31(40)38(22)24-9-5-3-6-10-24)34-30(39)23-13-14-32-27(21-23)37-15-7-4-8-16-37/h3,5-6,9-14,21H,4,7-8,15-20H2,1-2H3,(H,34,39)