3-(4-butoxyphenyl)carbonyl-2-(4-chlorophenyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(4-butoxyphenyl)carbonyl-2-(4-chlorophenyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(4-butoxybenzoyl)-2-(4-chlorophenyl)thiazolidine-4-carboxylic acid CAS Name: 3-[(4-butoxyphenyl)-oxomethyl]-2-(4-chlorophenyl)-4-thiazolidinecarboxylic acid IUPAC Name: 3-(4-butoxybenzoyl)-2-(4-chlorophenyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(4-butoxybenzoyl)-2-(4-chlorophenyl)thiazolidine-4-carboxylic acid Formula: C21H22ClNO4S MolecularWeight: 419.92168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C21H22ClNO4S/c1-2-3-12-27-17-10-6-14(7-11-17)19(24)23-18(21(25)26)13-28-20(23)15-4-8-16(22)9-5-15/h4-11,18,20H,2-3,12-13H2,1H3,(H,25,26)