methyl 2-(2-ethanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(2-ethanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-(2-acetylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(2-acetylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetic acid methyl ester IUPAC Name: methyl 2-(2-acetylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-acetylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C12H13N3O5S2 MolecularWeight: 343.37872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)N)CC(=O)OC

Isomeric SMILES

CC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)N)CC(=O)OC

InChI

InChI=1S/C12H13N3O5S2/c1-7(16)14-12-15(6-11(17)20-2)9-4-3-8(22(13,18)19)5-10(9)21-12/h3-5H,6H2,1-2H3,(H2,13,18,19)