1,3-benzothiazol-2-ylsulfanyl propanoate

Systemtic Name: 1,3-benzothiazol-2-ylsulfanyl propanoate Openeye Name: 1,3-benzothiazol-2-ylsulfanyl propanoate CAS Name: propanoic acid (1,3-benzothiazol-2-ylthio) ester IUPAC Name: 1,3-benzothiazol-2-ylsulfanyl propanoate Traditional Name: propionic acid (1,3-benzothiazol-2-ylthio) ester Formula: C10H9NO2S2 MolecularWeight: 239.31396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OSC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCC(=O)OSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C10H9NO2S2/c1-2-9(12)13-15-10-11-7-5-3-4-6-8(7)14-10/h3-6H,2H2,1H3