methyl 2-[(2Z)-5,6-dimethoxy-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(2Z)-5,6-dimethoxy-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-5,6-dimethoxy-2-(p-tolylsulfonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-5,6-dimethoxy-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-5,6-dimethoxy-2-(4-methylphenyl)sulfonylimino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-5,6-dimethoxy-2-tosylimino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C19H20N2O6S2 MolecularWeight: 436.5019

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C2N(C3=CC(=C(C=C3S2)OC)OC)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C\2/N(C3=CC(=C(C=C3S2)OC)OC)CC(=O)OC

InChI

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