3-(2-sulfanylidene-3H-1,3-thiazol-4-yl)propanoic acid

Systemtic Name: 3-(2-sulfanylidene-3H-1,3-thiazol-4-yl)propanoic acid Openeye Name: 3-(2-thioxo-3H-thiazol-4-yl)propanoic acid CAS Name: 3-(2-sulfanylidene-3H-thiazol-4-yl)propanoic acid IUPAC Name: 3-(2-sulfanylidene-3H-1,3-thiazol-4-yl)propanoic acid Traditional Name: 3-(2-thioxo-4-thiazolin-4-yl)propionic acid Formula: C6H7NO2S2 MolecularWeight: 189.25528

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=S)S1)CCC(=O)O

Isomeric SMILES

C1=C(NC(=S)S1)CCC(=O)O

InChI

InChI=1S/C6H7NO2S2/c8-5(9)2-1-4-3-11-6(10)7-4/h3H,1-2H2,(H,7,10)(H,8,9)