methyl 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-6-methoxy-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-6-methoxy-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-6-methoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-6-methoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-6-methoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-2-(4-chlorophenyl)sulfonylimino-6-methoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C17H15ClN2O5S2 MolecularWeight: 426.8944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=NS(=O)(=O)C3=CC=C(C=C3)Cl)S2)CC(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N(/C(=N/S(=O)(=O)C3=CC=C(C=C3)Cl)/S2)CC(=O)OC

InChI

InChI=1S/C17H15ClN2O5S2/c1-24-12-5-8-14-15(9-12)26-17(20(14)10-16(21)25-2)19-27(22,23)13-6-3-11(18)4-7-13/h3-9H,10H2,1-2H3/b19-17-