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

Systemtic Name: 2-(4-tert-butyl-2-sulfanylidene-1,3-thiazol-3-yl)propanoic acid Openeye Name: 2-(4-tert-butyl-2-thioxo-thiazol-3-yl)propanoic acid CAS Name: 2-(4-tert-butyl-2-sulfanylidene-3-thiazolyl)propanoic acid IUPAC Name: 2-(4-tert-butyl-2-sulfanylidene-1,3-thiazol-3-yl)propanoic acid Traditional Name: 2-(4-tert-butyl-2-thioxo-4-thiazolin-3-yl)propionic acid Formula: C10H15NO2S2 MolecularWeight: 245.3616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=CSC1=S)C(C)(C)C

Isomeric SMILES

CC(C(=O)O)N1C(=CSC1=S)C(C)(C)C

InChI

InChI=1S/C10H15NO2S2/c1-6(8(12)13)11-7(10(2,3)4)5-15-9(11)14/h5-6H,1-4H3,(H,12,13)