7-phenyl-4-(prop-2-enylamino)-2-(4-pyrimidin-2-ylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one

Systemtic Name: 7-phenyl-4-(prop-2-enylamino)-2-(4-pyrimidin-2-ylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one Openeye Name: 4-(allylamino)-7-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one CAS Name: 7-phenyl-4-(prop-2-enylamino)-2-[4-(2-pyrimidinyl)-1-piperazinyl]-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: 7-phenyl-4-(prop-2-enylamino)-2-(4-pyrimidin-2-ylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one Traditional Name: 4-(allylamino)-7-phenyl-2-[4-(2-pyrimidyl)piperazino]-7,8-dihydro-6H-quinazolin-5-one Formula: C25H27N7O MolecularWeight: 441.52818

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=NC2=C1C(=O)CC(C2)C3=CC=CC=C3)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C=CCNC1=NC(=NC2=C1C(=O)CC(C2)C3=CC=CC=C3)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C25H27N7O/c1-2-9-26-23-22-20(16-19(17-21(22)33)18-7-4-3-5-8-18)29-25(30-23)32-14-12-31(13-15-32)24-27-10-6-11-28-24/h2-8,10-11,19H,1,9,12-17H2,(H,26,29,30)