4-[(4-methoxyphenyl)amino]-7,7-dimethyl-2-[4-(phenylmethyl)piperazin-1-yl]-6,8-dihydroquinazolin-5-one

Systemtic Name: 4-[(4-methoxyphenyl)amino]-7,7-dimethyl-2-[4-(phenylmethyl)piperazin-1-yl]-6,8-dihydroquinazolin-5-one Openeye Name: 2-(4-benzylpiperazin-1-yl)-4-(4-methoxyanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one CAS Name: 4-(4-methoxyanilino)-7,7-dimethyl-2-[4-(phenylmethyl)-1-piperazinyl]-6,8-dihydroquinazolin-5-one IUPAC Name: 2-(4-benzylpiperazin-1-yl)-4-(4-methoxyanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one Traditional Name: 2-(4-benzylpiperazino)-7,7-dimethyl-4-(p-anisidino)-6,8-dihydroquinazolin-5-one Formula: C28H33N5O2 MolecularWeight: 471.59392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=NC(=N2)N3CCN(CC3)CC4=CC=CC=C4)NC5=CC=C(C=C5)OC)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=NC(=N2)N3CCN(CC3)CC4=CC=CC=C4)NC5=CC=C(C=C5)OC)C

InChI

InChI=1S/C28H33N5O2/c1-28(2)17-23-25(24(34)18-28)26(29-21-9-11-22(35-3)12-10-21)31-27(30-23)33-15-13-32(14-16-33)19-20-7-5-4-6-8-20/h4-12H,13-19H2,1-3H3,(H,29,30,31)