1-(3-chloranyl-4-methyl-phenyl)-3-[(2-methylphenyl)amino]-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(2-methylphenyl)amino]-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-(2-methylanilino)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(3-chloro-4-methylphenyl)-3-(2-methylanilino)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(2-methylanilino)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-(o-toluidino)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O2S MolecularWeight: 448.96444

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)Cl)NC4=CC=CC=C4C

Isomeric SMILES

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

InChI

InChI=1S/C25H21ClN2O2S/c1-15-8-12-19(13-9-15)31-23-22(27-21-7-5-4-6-17(21)3)24(29)28(25(23)30)18-11-10-16(2)20(26)14-18/h4-14,27H,1-3H3