ethanethioic S-acid; 1-methyl-3-sulfanyl-pyrrolidine-2,5-dione

Systemtic Name: ethanethioic S-acid; 1-methyl-3-sulfanyl-pyrrolidine-2,5-dione Openeye Name: ethanethioic S-acid; 1-methyl-3-sulfanyl-pyrrolidine-2,5-dione CAS Name: ethanethioic S-acid; 3-mercapto-1-methylpyrrolidine-2,5-dione IUPAC Name: ethanethioic S-acid; 1-methyl-3-sulfanylpyrrolidine-2,5-dione Traditional Name: 3-mercapto-1-methyl-pyrrolidine-2,5-quinone; thioacetic acid Formula: C7H11NO3S2 MolecularWeight: 221.29714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)S.CN1C(=O)CC(C1=O)S

Isomeric SMILES

CC(=O)S.CN1C(=O)CC(C1=O)S

InChI

InChI=1S/C5H7NO2S.C2H4OS/c1-6-4(7)2-3(9)5(6)8;1-2(3)4/h3,9H,2H2,1H3;1H3,(H,3,4)