3-(4-bromophenyl)carbonyl-2-(4-tert-butylphenyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(4-bromophenyl)carbonyl-2-(4-tert-butylphenyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(4-bromobenzoyl)-2-(4-tert-butylphenyl)thiazolidine-4-carboxylic acid CAS Name: 3-[(4-bromophenyl)-oxomethyl]-2-(4-tert-butylphenyl)-4-thiazolidinecarboxylic acid IUPAC Name: 3-(4-bromobenzoyl)-2-(4-tert-butylphenyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(4-bromobenzoyl)-2-(4-tert-butylphenyl)thiazolidine-4-carboxylic acid Formula: C21H22BrNO3S MolecularWeight: 448.37328

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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)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2N(C(CS2)C(=O)O)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrNO3S/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)