3-[5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 3-[5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[5-[1-(3,4-dimethylphenyl)ethylidene]-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=C2C(=O)N(C(=S)S2)CCC(=O)O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=C2C(=O)N(C(=S)S2)CCC(=O)O)C)C

InChI

InChI=1S/C16H17NO3S2/c1-9-4-5-12(8-10(9)2)11(3)14-15(20)17(16(21)22-14)7-6-13(18)19/h4-5,8H,6-7H2,1-3H3,(H,18,19)