S-(1,3-benzothiazol-2-yl) 2-(4-methoxyphenoxy)ethanethioate

Systemtic Name: S-(1,3-benzothiazol-2-yl) 2-(4-methoxyphenoxy)ethanethioate Openeye Name: S-(1,3-benzothiazol-2-yl) 2-(4-methoxyphenoxy)ethanethioate CAS Name: 2-(4-methoxyphenoxy)ethanethioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) 2-(4-methoxyphenoxy)ethanethioate Traditional Name: 2-(4-methoxyphenoxy)ethanethioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C16H13NO3S2 MolecularWeight: 331.40932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(=O)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC=C(C=C1)OCC(=O)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13NO3S2/c1-19-11-6-8-12(9-7-11)20-10-15(18)22-16-17-13-4-2-3-5-14(13)21-16/h2-9H,10H2,1H3