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

Systemtic Name: methyl 2-[(3-oxidanylidene-1,2-benzothiazol-2-yl)sulfanyl]benzoate Openeye Name: methyl 2-[(3-oxo-1,2-benzothiazol-2-yl)sulfanyl]benzoate CAS Name: 2-[(3-oxo-1,2-benzothiazol-2-yl)thio]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-oxo-1,2-benzothiazol-2-yl)sulfanyl]benzoate Traditional Name: 2-[(3-keto-1,2-benzothiazol-2-yl)thio]benzoic acid methyl ester Formula: C15H11NO3S2 MolecularWeight: 317.38274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11NO3S2/c1-19-15(18)11-7-3-5-9-13(11)21-16-14(17)10-6-2-4-8-12(10)20-16/h2-9H,1H3