(2R)-2-(1,3-benzothiazol-2-ylsulfanyl)butanoate

Systemtic Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)butanoate Openeye Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)butanoate CAS Name: (2R)-2-(1,3-benzothiazol-2-ylthio)butanoate IUPAC Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)butanoate Traditional Name: (2R)-2-(1,3-benzothiazol-2-ylthio)butyrate Formula: C11H10NO2S2- MolecularWeight: 252.3326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])SC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC[C@H](C(=O)[O-])SC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C11H11NO2S2/c1-2-8(10(13)14)15-11-12-7-5-3-4-6-9(7)16-11/h3-6,8H,2H2,1H3,(H,13,14)/p-1/t8-/m1/s1