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

Systemtic Name: ethyl 2-[(2Z)-6-ethoxy-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[(2Z)-6-ethoxy-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-6-ethoxy-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2Z)-6-ethoxy-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-6-ethoxy-2-(4-fluorophenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C19H19FN2O5S2 MolecularWeight: 438.492963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NS(=O)(=O)C3=CC=C(C=C3)F)S2)CC(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(/C(=N/S(=O)(=O)C3=CC=C(C=C3)F)/S2)CC(=O)OCC

InChI

InChI=1S/C19H19FN2O5S2/c1-3-26-14-7-10-16-17(11-14)28-19(22(16)12-18(23)27-4-2)21-29(24,25)15-8-5-13(20)6-9-15/h5-11H,3-4,12H2,1-2H3/b21-19-