2-(4-ethyl-5-methyl-2-sulfanylidene-1,3-thiazol-3-yl)propanoic acid

Systemtic Name: 2-(4-ethyl-5-methyl-2-sulfanylidene-1,3-thiazol-3-yl)propanoic acid Openeye Name: 2-(4-ethyl-5-methyl-2-thioxo-thiazol-3-yl)propanoic acid CAS Name: 2-(4-ethyl-5-methyl-2-sulfanylidene-3-thiazolyl)propanoic acid IUPAC Name: 2-(4-ethyl-5-methyl-2-sulfanylidene-1,3-thiazol-3-yl)propanoic acid Traditional Name: 2-(4-ethyl-5-methyl-2-thioxo-4-thiazolin-3-yl)propionic acid Formula: C9H13NO2S2 MolecularWeight: 231.33502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=S)N1C(C)C(=O)O)C

Isomeric SMILES

CCC1=C(SC(=S)N1C(C)C(=O)O)C

InChI

InChI=1S/C9H13NO2S2/c1-4-7-6(3)14-9(13)10(7)5(2)8(11)12/h5H,4H2,1-3H3,(H,11,12)