3-(4-propan-2-ylsulfanylphenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-(4-propan-2-ylsulfanylphenyl)pyrrolidine-2,5-dione Openeye Name: 3-(4-isopropylsulfanylphenyl)pyrrolidine-2,5-dione CAS Name: 3-[4-(propan-2-ylthio)phenyl]pyrrolidine-2,5-dione IUPAC Name: 3-(4-propan-2-ylsulfanylphenyl)pyrrolidine-2,5-dione Traditional Name: 3-[4-(isopropylthio)phenyl]pyrrolidine-2,5-quinone Formula: C13H15NO2S MolecularWeight: 249.3287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)C2CC(=O)NC2=O

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)C2CC(=O)NC2=O

InChI

InChI=1S/C13H15NO2S/c1-8(2)17-10-5-3-9(4-6-10)11-7-12(15)14-13(11)16/h3-6,8,11H,7H2,1-2H3,(H,14,15,16)