ethyl 2-[(3-oxidanylidene-1,2-benzothiazol-2-yl)sulfanyl]benzoate

Systemtic Name: ethyl 2-[(3-oxidanylidene-1,2-benzothiazol-2-yl)sulfanyl]benzoate Openeye Name: ethyl 2-[(3-oxo-1,2-benzothiazol-2-yl)sulfanyl]benzoate CAS Name: 2-[(3-oxo-1,2-benzothiazol-2-yl)thio]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(3-oxo-1,2-benzothiazol-2-yl)sulfanyl]benzoate Traditional Name: 2-[(3-keto-1,2-benzothiazol-2-yl)thio]benzoic acid ethyl ester Formula: C16H13NO3S2 MolecularWeight: 331.40932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1SN2C(=O)C3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1SN2C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C16H13NO3S2/c1-2-20-16(19)12-8-4-6-10-14(12)22-17-15(18)11-7-3-5-9-13(11)21-17/h3-10H,2H2,1H3