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

Systemtic Name: 2-chloranyl-N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-3-yl]phenyl]pyridine-4-carboxamide Openeye Name: 2-chloro-N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]phenyl]pyridine-4-carboxamide CAS Name: 2-chloro-N-[4-methyl-3-[6-(4-methyl-1-piperazinyl)-4-oxo-3-quinazolinyl]phenyl]-4-pyridinecarboxamide IUPAC Name: 2-chloro-N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxoquinazolin-3-yl]phenyl]pyridine-4-carboxamide Traditional Name: 2-chloro-N-[3-[4-keto-6-(4-methylpiperazino)quinazolin-3-yl]-4-methyl-phenyl]isonicotinamide Formula: C26H25ClN6O2 MolecularWeight: 488.9687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)Cl)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)Cl)N3C=NC4=C(C3=O)C=C(C=C4)N5CCN(CC5)C

InChI

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