methyl 2-[(2Z)-5,6-dimethyl-2-(phenylsulfonylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(2Z)-5,6-dimethyl-2-(phenylsulfonylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-2-(benzenesulfonylimino)-5,6-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-2-(benzenesulfonylimino)-5,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-2-(benzenesulfonylimino)-5,6-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-2-besylimino-5,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C18H18N2O4S2 MolecularWeight: 390.47652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NS(=O)(=O)C3=CC=CC=C3)N2CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)S/C(=N\S(=O)(=O)C3=CC=CC=C3)/N2CC(=O)OC

InChI

InChI=1S/C18H18N2O4S2/c1-12-9-15-16(10-13(12)2)25-18(20(15)11-17(21)24-3)19-26(22,23)14-7-5-4-6-8-14/h4-10H,11H2,1-3H3/b19-18-