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

Systemtic Name: S-(1,3-benzothiazol-2-yl) 2-(4-methoxyphenyl)ethanethioate Openeye Name: S-(1,3-benzothiazol-2-yl) 2-(4-methoxyphenyl)ethanethioate CAS Name: 2-(4-methoxyphenyl)ethanethioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) 2-(4-methoxyphenyl)ethanethioate Traditional Name: 2-(4-methoxyphenyl)ethanethioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C16H13NO2S2 MolecularWeight: 315.40992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO2S2/c1-19-12-8-6-11(7-9-12)10-15(18)21-16-17-13-4-2-3-5-14(13)20-16/h2-9H,10H2,1H3