dimethyl (2S,4S)-3-(2-cyanoethanoyl)-1,3-thiazolidine-2,4-dicarboxylate

Systemtic Name: dimethyl (2S,4S)-3-(2-cyanoethanoyl)-1,3-thiazolidine-2,4-dicarboxylate Openeye Name: dimethyl (2S,4S)-3-(2-cyanoacetyl)thiazolidine-2,4-dicarboxylate CAS Name: (2S,4S)-3-(2-cyano-1-oxoethyl)thiazolidine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,4S)-3-(2-cyanoacetyl)-1,3-thiazolidine-2,4-dicarboxylate Traditional Name: (2S,4S)-3-(2-cyanoacetyl)thiazolidine-2,4-dicarboxylic acid dimethyl ester Formula: C10H12N2O5S MolecularWeight: 272.27768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CSC(N1C(=O)CC#N)C(=O)OC

Isomeric SMILES

COC(=O)[C@H]1CS[C@H](N1C(=O)CC#N)C(=O)OC

InChI

InChI=1S/C10H12N2O5S/c1-16-9(14)6-5-18-8(10(15)17-2)12(6)7(13)3-4-11/h6,8H,3,5H2,1-2H3/t6-,8+/m1/s1