ethyl 2-[(2Z)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[(2Z)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[(2Z)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2Z)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C17H15FN2O4S2 MolecularWeight: 394.440403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2SC1=NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)CN\1C2=CC=CC=C2S/C1=N\S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H15FN2O4S2/c1-2-24-16(21)11-20-14-5-3-4-6-15(14)25-17(20)19-26(22,23)13-9-7-12(18)8-10-13/h3-10H,2,11H2,1H3/b19-17-