(2S,4R)-3-ethylsulfanylcarbothioyl-2-(4-methylphenyl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: (2S,4R)-3-ethylsulfanylcarbothioyl-2-(4-methylphenyl)-1,3-thiazolidine-4-carboxylate Openeye Name: (2S,4R)-3-ethylsulfanylcarbothioyl-2-(p-tolyl)thiazolidine-4-carboxylate CAS Name: (2S,4R)-3-[(ethylthio)-sulfanylidenemethyl]-2-(4-methylphenyl)-4-thiazolidinecarboxylate IUPAC Name: (2S,4R)-3-ethylsulfanylcarbothioyl-2-(4-methylphenyl)-1,3-thiazolidine-4-carboxylate Traditional Name: (2S,4R)-3-(ethylthio)carbothioyl-2-(p-tolyl)thiazolidine-4-carboxylate Formula: C14H16NO2S3- MolecularWeight: 326.47734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=S)N1C(CSC1C2=CC=C(C=C2)C)C(=O)[O-]

Isomeric SMILES

CCSC(=S)N1[C@@H](CS[C@H]1C2=CC=C(C=C2)C)C(=O)[O-]

InChI

InChI=1S/C14H17NO2S3/c1-3-19-14(18)15-11(13(16)17)8-20-12(15)10-6-4-9(2)5-7-10/h4-7,11-12H,3,8H2,1-2H3,(H,16,17)/p-1/t11-,12-/m0/s1