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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3,4-bis[(4-methylphenyl)sulfanyl]pyrrole-2,5-dione Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3,4-bis(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(3-chloro-4-methylphenyl)-3,4-bis[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 1-(3-chloro-4-methylphenyl)-3,4-bis[(4-methylphenyl)sulfanyl]pyrrole-2,5-dione Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3,4-bis(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C25H20ClNO2S2 MolecularWeight: 466.0148

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)SC4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)SC4=CC=C(C=C4)C

InChI

InChI=1S/C25H20ClNO2S2/c1-15-4-10-19(11-5-15)30-22-23(31-20-12-6-16(2)7-13-20)25(29)27(24(22)28)18-9-8-17(3)21(26)14-18/h4-14H,1-3H3