ethyl (2Z)-3-(2-ethoxy-2-oxidanylidene-ethyl)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl (2Z)-3-(2-ethoxy-2-oxidanylidene-ethyl)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl (2Z)-3-(2-ethoxy-2-oxo-ethyl)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazole-6-carboxylate CAS Name: (2Z)-3-(2-ethoxy-2-oxoethyl)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2Z)-3-(2-ethoxy-2-oxoethyl)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazole-6-carboxylate Traditional Name: (2Z)-3-(2-ethoxy-2-keto-ethyl)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C20H19FN2O6S2 MolecularWeight: 466.503063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)CN\1C2=C(C=C(C=C2)C(=O)OCC)S/C1=N\S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN2O6S2/c1-3-28-18(24)12-23-16-10-5-13(19(25)29-4-2)11-17(16)30-20(23)22-31(26,27)15-8-6-14(21)7-9-15/h5-11H,3-4,12H2,1-2H3/b22-20-