ethyl 2-[(2Z)-4,7-dimethoxy-2-(phenylsulfonylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[(2Z)-4,7-dimethoxy-2-(phenylsulfonylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[(2Z)-2-(benzenesulfonylimino)-4,7-dimethoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-2-(benzenesulfonylimino)-4,7-dimethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2Z)-2-(benzenesulfonylimino)-4,7-dimethoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-2-besylimino-4,7-dimethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C19H20N2O6S2 MolecularWeight: 436.5019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O6S2/c1-4-27-16(22)12-21-17-14(25-2)10-11-15(26-3)18(17)28-19(21)20-29(23,24)13-8-6-5-7-9-13/h5-11H,4,12H2,1-3H3/b20-19-