(2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-(1,3-benzothiazol-2-yl)benzoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-(1,3-benzothiazol-2-yl)benzoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 2-(1,3-benzothiazol-2-yl)benzoate CAS Name: 2-(1,3-benzothiazol-2-yl)benzoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 2-(1,3-benzothiazol-2-yl)benzoate Traditional Name: 2-(1,3-benzothiazol-2-yl)benzoic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C20H13NO3S2 MolecularWeight: 379.45212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)OCC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)OCC(=O)C4=CC=CS4

InChI

InChI=1S/C20H13NO3S2/c22-16(18-10-5-11-25-18)12-24-20(23)14-7-2-1-6-13(14)19-21-15-8-3-4-9-17(15)26-19/h1-11H,12H2