2-chloranyl-N-[2-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-quinazolin-5-yl]pyridine-4-carboxamide

Systemtic Name: 2-chloranyl-N-[2-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-quinazolin-5-yl]pyridine-4-carboxamide Openeye Name: 2-chloro-N-[6-(4-methylpiperazin-1-yl)-2-(o-tolyl)-4-oxo-1H-quinazolin-5-yl]pyridine-4-carboxamide CAS Name: 2-chloro-N-[2-(2-methylphenyl)-6-(4-methyl-1-piperazinyl)-4-oxo-1H-quinazolin-5-yl]-4-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)-4-oxo-1H-quinazolin-5-yl]pyridine-4-carboxamide Traditional Name: 2-chloro-N-[4-keto-6-(4-methylpiperazino)-2-(o-tolyl)-1H-quinazolin-5-yl]isonicotinamide Formula: C26H25ClN6O2 MolecularWeight: 488.9687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=O)C3=C(N2)C=CC(=C3NC(=O)C4=CC(=NC=C4)Cl)N5CCN(CC5)C

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=O)C3=C(N2)C=CC(=C3NC(=O)C4=CC(=NC=C4)Cl)N5CCN(CC5)C

InChI

InChI=1S/C26H25ClN6O2/c1-16-5-3-4-6-18(16)24-29-19-7-8-20(33-13-11-32(2)12-14-33)23(22(19)26(35)31-24)30-25(34)17-9-10-28-21(27)15-17/h3-10,15H,11-14H2,1-2H3,(H,30,34)(H,29,31,35)