6-methyl-9-(4-methylphenyl)-2-[(4-methylphenyl)amino]-7H-purine-8-thione

Systemtic Name: 6-methyl-9-(4-methylphenyl)-2-[(4-methylphenyl)amino]-7H-purine-8-thione Openeye Name: 6-methyl-2-(4-methylanilino)-9-(p-tolyl)-7H-purine-8-thione CAS Name: 6-methyl-2-(4-methylanilino)-9-(4-methylphenyl)-7H-purine-8-thione IUPAC Name: 6-methyl-2-(4-methylanilino)-9-(4-methylphenyl)-7H-purine-8-thione Traditional Name: 6-methyl-2-(p-toluidino)-9-(p-tolyl)-7H-purine-8-thione Formula: C20H19N5S MolecularWeight: 361.46336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=C3C(=N2)N(C(=S)N3)C4=CC=C(C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=C3C(=N2)N(C(=S)N3)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C20H19N5S/c1-12-4-8-15(9-5-12)22-19-21-14(3)17-18(24-19)25(20(26)23-17)16-10-6-13(2)7-11-16/h4-11H,1-3H3,(H,23,26)(H,21,22,24)