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

Systemtic Name: methyl 2-[(2Z)-4-fluoranyl-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-4-fluoro-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-4-fluoro-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-4-fluoro-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-4-fluoro-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C16H12F2N2O4S2 MolecularWeight: 398.404286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12F2N2O4S2/c1-24-14(21)9-20-15-12(18)3-2-4-13(15)25-16(20)19-26(22,23)11-7-5-10(17)6-8-11/h2-8H,9H2,1H3/b19-16-