4-[2,4-bis(oxidanyl)phenyl]-4-(4-methoxyphenyl)-6-phenyl-1,3-diazinane-2-thione

Systemtic Name: 4-[2,4-bis(oxidanyl)phenyl]-4-(4-methoxyphenyl)-6-phenyl-1,3-diazinane-2-thione Openeye Name: 4-(2,4-dihydroxyphenyl)-4-(4-methoxyphenyl)-6-phenyl-hexahydropyrimidine-2-thione CAS Name: 4-(2,4-dihydroxyphenyl)-4-(4-methoxyphenyl)-6-phenyl-1,3-diazinane-2-thione IUPAC Name: 4-(2,4-dihydroxyphenyl)-4-(4-methoxyphenyl)-6-phenyl-1,3-diazinane-2-thione Traditional Name: 4-(2,4-dihydroxyphenyl)-4-(4-methoxyphenyl)-6-phenyl-hexahydropyrimidine-2-thione Formula: C23H22N2O3S MolecularWeight: 406.49738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC(NC(=S)N2)C3=CC=CC=C3)C4=C(C=C(C=C4)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC(NC(=S)N2)C3=CC=CC=C3)C4=C(C=C(C=C4)O)O

InChI

InChI=1S/C23H22N2O3S/c1-28-18-10-7-16(8-11-18)23(19-12-9-17(26)13-21(19)27)14-20(24-22(29)25-23)15-5-3-2-4-6-15/h2-13,20,26-27H,14H2,1H3,(H2,24,25,29)