methyl 2-[2-(1,2-oxazol-5-ylcarbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(1,2-oxazol-5-ylcarbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(isoxazole-5-carbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[5-isoxazolyl(oxo)methyl]imino-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(1,2-oxazole-5-carbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(isoxazole-5-carbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C14H12N4O6S2 MolecularWeight: 396.39828

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC=NO3

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC=NO3

InChI

InChI=1S/C14H12N4O6S2/c1-23-12(19)7-18-9-3-2-8(26(15,21)22)6-11(9)25-14(18)17-13(20)10-4-5-16-24-10/h2-6H,7H2,1H3,(H2,15,21,22)