3-methyl-1-(4-methylsulfanylphenyl)pyrrole-2,5-dione

Systemtic Name: 3-methyl-1-(4-methylsulfanylphenyl)pyrrole-2,5-dione Openeye Name: 3-methyl-1-(4-methylsulfanylphenyl)pyrrole-2,5-dione CAS Name: 3-methyl-1-[4-(methylthio)phenyl]pyrrole-2,5-dione IUPAC Name: 3-methyl-1-(4-methylsulfanylphenyl)pyrrole-2,5-dione Traditional Name: 3-methyl-1-[4-(methylthio)phenyl]-3-pyrroline-2,5-quinone Formula: C12H11NO2S MolecularWeight: 233.28624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC(=O)N(C1=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C12H11NO2S/c1-8-7-11(14)13(12(8)15)9-3-5-10(16-2)6-4-9/h3-7H,1-2H3