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

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[(2-ethoxyphenyl)amino]-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione Openeye Name: 1-(3,5-dimethylphenyl)-3-(2-ethoxyanilino)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(3,5-dimethylphenyl)-3-(2-ethoxyanilino)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 1-(3,5-dimethylphenyl)-3-(2-ethoxyanilino)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 1-(3,5-dimethylphenyl)-3-(o-phenetidino)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C27H26N2O3S MolecularWeight: 458.57194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=C(C(=O)N(C2=O)C3=CC(=CC(=C3)C)C)SC4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=CC=C1NC2=C(C(=O)N(C2=O)C3=CC(=CC(=C3)C)C)SC4=CC=C(C=C4)C

InChI

InChI=1S/C27H26N2O3S/c1-5-32-23-9-7-6-8-22(23)28-24-25(33-21-12-10-17(2)11-13-21)27(31)29(26(24)30)20-15-18(3)14-19(4)16-20/h6-16,28H,5H2,1-4H3