ethyl 2-[(2Z)-6-ethyl-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[(2Z)-6-ethyl-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[(2Z)-6-ethyl-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-6-ethyl-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2Z)-6-ethyl-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-6-ethyl-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C19H19FN2O4S2 MolecularWeight: 422.493563

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=NS(=O)(=O)C3=CC=C(C=C3)F)S2)CC(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)N(/C(=N/S(=O)(=O)C3=CC=C(C=C3)F)/S2)CC(=O)OCC

InChI

InChI=1S/C19H19FN2O4S2/c1-3-13-5-10-16-17(11-13)27-19(22(16)12-18(23)26-4-2)21-28(24,25)15-8-6-14(20)7-9-15/h5-11H,3-4,12H2,1-2H3/b21-19-