3-[2-ethanoylsulfanyl-4-(4-methoxyphenyl)-4-oxidanylidene-butanoyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[2-ethanoylsulfanyl-4-(4-methoxyphenyl)-4-oxidanylidene-butanoyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[2-acetylsulfanyl-4-(4-methoxyphenyl)-4-oxo-butanoyl]thiazolidine-4-carboxylic acid CAS Name: 3-[2-(acetylthio)-4-(4-methoxyphenyl)-1,4-dioxobutyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-[2-acetylsulfanyl-4-(4-methoxyphenyl)-4-oxobutanoyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[2-(acetylthio)-4-keto-4-(4-methoxyphenyl)butanoyl]thiazolidine-4-carboxylic acid Formula: C17H19NO6S2 MolecularWeight: 397.46586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)C1=CC=C(C=C1)OC)C(=O)N2CSCC2C(=O)O

Isomeric SMILES

CC(=O)SC(CC(=O)C1=CC=C(C=C1)OC)C(=O)N2CSCC2C(=O)O

InChI

InChI=1S/C17H19NO6S2/c1-10(19)26-15(16(21)18-9-25-8-13(18)17(22)23)7-14(20)11-3-5-12(24-2)6-4-11/h3-6,13,15H,7-9H2,1-2H3,(H,22,23)