2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoate

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoate Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)acetate IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)acetate Formula: C10H8NO2S2- MolecularWeight: 238.30602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CSCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CSCC(=O)[O-]

InChI

InChI=1S/C10H9NO2S2/c12-10(13)6-14-5-9-11-7-3-1-2-4-8(7)15-9/h1-4H,5-6H2,(H,12,13)/p-1