butyl (2S,4S)-3-(4-methylphenyl)carbonyl-2-propan-2-yl-1,3-thiazolidine-4-carboxylate

Systemtic Name: butyl (2S,4S)-3-(4-methylphenyl)carbonyl-2-propan-2-yl-1,3-thiazolidine-4-carboxylate Openeye Name: butyl (2S,4S)-2-isopropyl-3-(4-methylbenzoyl)thiazolidine-4-carboxylate CAS Name: (2S,4S)-3-[(4-methylphenyl)-oxomethyl]-2-propan-2-yl-4-thiazolidinecarboxylic acid butyl ester IUPAC Name: butyl (2S,4S)-3-(4-methylbenzoyl)-2-propan-2-yl-1,3-thiazolidine-4-carboxylate Traditional Name: (2S,4S)-2-isopropyl-3-p-toluoyl-thiazolidine-4-carboxylic acid butyl ester Formula: C19H27NO3S MolecularWeight: 349.48758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSC(N1C(=O)C2=CC=C(C=C2)C)C(C)C

Isomeric SMILES

CCCCOC(=O)[C@H]1CS[C@H](N1C(=O)C2=CC=C(C=C2)C)C(C)C

InChI

InChI=1S/C19H27NO3S/c1-5-6-11-23-19(22)16-12-24-18(13(2)3)20(16)17(21)15-9-7-14(4)8-10-15/h7-10,13,16,18H,5-6,11-12H2,1-4H3/t16-,18+/m1/s1