3-[(2,3-dimethylphenyl)amino]-4-(4-methylphenyl)sulfanyl-1-(4-propan-2-ylphenyl)pyrrole-2,5-dione

Systemtic Name: 3-[(2,3-dimethylphenyl)amino]-4-(4-methylphenyl)sulfanyl-1-(4-propan-2-ylphenyl)pyrrole-2,5-dione Openeye Name: 3-(2,3-dimethylanilino)-1-(4-isopropylphenyl)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(2,3-dimethylanilino)-4-[(4-methylphenyl)thio]-1-(4-propan-2-ylphenyl)pyrrole-2,5-dione IUPAC Name: 3-(2,3-dimethylanilino)-4-(4-methylphenyl)sulfanyl-1-(4-propan-2-ylphenyl)pyrrole-2,5-dione Traditional Name: 3-(2,3-dimethylanilino)-1-p-cumenyl-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C28H28N2O2S MolecularWeight: 456.59912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)C(C)C)NC4=CC=CC(=C4C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)C(C)C)NC4=CC=CC(=C4C)C

InChI

InChI=1S/C28H28N2O2S/c1-17(2)21-11-13-22(14-12-21)30-27(31)25(29-24-8-6-7-19(4)20(24)5)26(28(30)32)33-23-15-9-18(3)10-16-23/h6-17,29H,1-5H3