3-(2,6-dimethylphenyl)-2-[(4-nitrophenyl)amino]-5,5-diphenyl-imidazole-4-thione

Systemtic Name: 3-(2,6-dimethylphenyl)-2-[(4-nitrophenyl)amino]-5,5-diphenyl-imidazole-4-thione Openeye Name: 3-(2,6-dimethylphenyl)-2-(4-nitroanilino)-5,5-diphenyl-imidazole-4-thione CAS Name: 3-(2,6-dimethylphenyl)-2-(4-nitroanilino)-5,5-diphenyl-4-imidazolethione IUPAC Name: 3-(2,6-dimethylphenyl)-2-(4-nitroanilino)-5,5-diphenylimidazole-4-thione Traditional Name: 3-(2,6-dimethylphenyl)-2-(4-nitroanilino)-5,5-diphenyl-2-imidazoline-4-thione Formula: C29H24N4O2S MolecularWeight: 492.59146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=S)C(N=C2NC3=CC=C(C=C3)[N+](=O)[O-])(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=S)C(N=C2NC3=CC=C(C=C3)[N+](=O)[O-])(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H24N4O2S/c1-20-10-9-11-21(2)26(20)32-27(36)29(22-12-5-3-6-13-22,23-14-7-4-8-15-23)31-28(32)30-24-16-18-25(19-17-24)33(34)35/h3-19H,1-2H3,(H,30,31)