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

Systemtic Name: 2-(4-methylpiperazin-1-yl)-7-phenyl-4-(prop-2-enylamino)-7,8-dihydro-6H-quinazolin-5-one Openeye Name: 4-(allylamino)-2-(4-methylpiperazin-1-yl)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one CAS Name: 2-(4-methyl-1-piperazinyl)-7-phenyl-4-(prop-2-enylamino)-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: 2-(4-methylpiperazin-1-yl)-7-phenyl-4-(prop-2-enylamino)-7,8-dihydro-6H-quinazolin-5-one Traditional Name: 4-(allylamino)-2-(4-methylpiperazino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=C(C(=O)CC(C3)C4=CC=CC=C4)C(=N2)NCC=C

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(C(=O)CC(C3)C4=CC=CC=C4)C(=N2)NCC=C

InChI

InChI=1S/C22H27N5O/c1-3-9-23-21-20-18(24-22(25-21)27-12-10-26(2)11-13-27)14-17(15-19(20)28)16-7-5-4-6-8-16/h3-8,17H,1,9-15H2,2H3,(H,23,24,25)