5-[(4-methylphenyl)methyl]-7-(2-methylpropyl)-4-(4-phenylpiperazin-1-yl)-7,8-dihydropteridin-6-one

Systemtic Name: 5-[(4-methylphenyl)methyl]-7-(2-methylpropyl)-4-(4-phenylpiperazin-1-yl)-7,8-dihydropteridin-6-one Openeye Name: 7-isobutyl-4-(4-phenylpiperazin-1-yl)-5-(p-tolylmethyl)-7,8-dihydropteridin-6-one CAS Name: 5-[(4-methylphenyl)methyl]-7-(2-methylpropyl)-4-(4-phenyl-1-piperazinyl)-7,8-dihydropteridin-6-one IUPAC Name: 5-[(4-methylphenyl)methyl]-7-(2-methylpropyl)-4-(4-phenylpiperazin-1-yl)-7,8-dihydropteridin-6-one Traditional Name: 7-isobutyl-5-(4-methylbenzyl)-4-(4-phenylpiperazino)-7,8-dihydropteridin-6-one Formula: C28H34N6O MolecularWeight: 470.60916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C(NC3=C2C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C(NC3=C2C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5)CC(C)C

InChI

InChI=1S/C28H34N6O/c1-20(2)17-24-28(35)34(18-22-11-9-21(3)10-12-22)25-26(31-24)29-19-30-27(25)33-15-13-32(14-16-33)23-7-5-4-6-8-23/h4-12,19-20,24H,13-18H2,1-3H3,(H,29,30,31)