3-[(2-tert-butyl-1,3-thiazol-5-yl)sulfanyl]propanoic acid

Systemtic Name: 3-[(2-tert-butyl-1,3-thiazol-5-yl)sulfanyl]propanoic acid Openeye Name: 3-(2-tert-butylthiazol-5-yl)sulfanylpropanoic acid CAS Name: 3-[(2-tert-butyl-5-thiazolyl)thio]propanoic acid IUPAC Name: 3-[(2-tert-butyl-1,3-thiazol-5-yl)sulfanyl]propanoic acid Traditional Name: 3-[(2-tert-butylthiazol-5-yl)thio]propionic acid Formula: C10H15NO2S2 MolecularWeight: 245.3616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(S1)SCCC(=O)O

Isomeric SMILES

CC(C)(C)C1=NC=C(S1)SCCC(=O)O

InChI

InChI=1S/C10H15NO2S2/c1-10(2,3)9-11-6-8(15-9)14-5-4-7(12)13/h6H,4-5H2,1-3H3,(H,12,13)