(2S,4S)-2-(4-tert-butylphenyl)-3-(4-chlorophenyl)carbonyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: (2S,4S)-2-(4-tert-butylphenyl)-3-(4-chlorophenyl)carbonyl-1,3-thiazolidine-4-carboxylate Openeye Name: (2S,4S)-2-(4-tert-butylphenyl)-3-(4-chlorobenzoyl)thiazolidine-4-carboxylate CAS Name: (2S,4S)-2-(4-tert-butylphenyl)-3-[(4-chlorophenyl)-oxomethyl]-4-thiazolidinecarboxylate IUPAC Name: (2S,4S)-2-(4-tert-butylphenyl)-3-(4-chlorobenzoyl)-1,3-thiazolidine-4-carboxylate Traditional Name: (2S,4S)-2-(4-tert-butylphenyl)-3-(4-chlorobenzoyl)thiazolidine-4-carboxylate Formula: C21H21ClNO3S- MolecularWeight: 402.91434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2N(C(CS2)C(=O)[O-])C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@H]2N([C@H](CS2)C(=O)[O-])C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClNO3S/c1-21(2,3)15-8-4-14(5-9-15)19-23(17(12-27-19)20(25)26)18(24)13-6-10-16(22)11-7-13/h4-11,17,19H,12H2,1-3H3,(H,25,26)/p-1/t17-,19+/m1/s1