2-(1,3-benzothiazol-2-yl)-2-sulfanyl-ethanoic acid

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-sulfanyl-ethanoic acid Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-sulfanyl-acetic acid CAS Name: 2-(1,3-benzothiazol-2-yl)-2-mercaptoacetic acid IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-sulfanylacetic acid Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-mercapto-acetic acid Formula: C9H7NO2S2 MolecularWeight: 225.28738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(C(=O)O)S

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(C(=O)O)S

InChI

InChI=1S/C9H7NO2S2/c11-9(12)7(13)8-10-5-3-1-2-4-6(5)14-8/h1-4,7,13H,(H,11,12)