4-[(4-chlorophenyl)amino]-7,7-dimethyl-2-(4-pyridin-2-ylpiperazin-1-yl)-6,8-dihydroquinazolin-5-one

Systemtic Name: 4-[(4-chlorophenyl)amino]-7,7-dimethyl-2-(4-pyridin-2-ylpiperazin-1-yl)-6,8-dihydroquinazolin-5-one Openeye Name: 4-(4-chloroanilino)-7,7-dimethyl-2-[4-(2-pyridyl)piperazin-1-yl]-6,8-dihydroquinazolin-5-one CAS Name: 4-(4-chloroanilino)-7,7-dimethyl-2-[4-(2-pyridinyl)-1-piperazinyl]-6,8-dihydroquinazolin-5-one IUPAC Name: 4-(4-chloroanilino)-7,7-dimethyl-2-(4-pyridin-2-ylpiperazin-1-yl)-6,8-dihydroquinazolin-5-one Traditional Name: 4-(4-chloroanilino)-7,7-dimethyl-2-[4-(2-pyridyl)piperazino]-6,8-dihydroquinazolin-5-one Formula: C25H27ClN6O MolecularWeight: 462.97448

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=N4)NC5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=N4)NC5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C25H27ClN6O/c1-25(2)15-19-22(20(33)16-25)23(28-18-8-6-17(26)7-9-18)30-24(29-19)32-13-11-31(12-14-32)21-5-3-4-10-27-21/h3-10H,11-16H2,1-2H3,(H,28,29,30)