1-sulfanylidenepropan-2-yl 4-methylbenzenesulfonate

Systemtic Name: 1-sulfanylidenepropan-2-yl 4-methylbenzenesulfonate Openeye Name: (1-methyl-2-thioxo-ethyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-sulfanylidenepropan-2-yl ester IUPAC Name: 1-sulfanylidenepropan-2-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-methyl-2-thioxo-ethyl) ester Formula: C10H12O3S2 MolecularWeight: 244.33048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C=S

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C=S

InChI

InChI=1S/C10H12O3S2/c1-8-3-5-10(6-4-8)15(11,12)13-9(2)7-14/h3-7,9H,1-2H3