2-(1,3-benzothiazol-5-yl)-2-sulfamoyl-butanoate

Systemtic Name: 2-(1,3-benzothiazol-5-yl)-2-sulfamoyl-butanoate Openeye Name: 2-(1,3-benzothiazol-5-yl)-2-sulfamoyl-butanoate CAS Name: 2-(1,3-benzothiazol-5-yl)-2-sulfamoylbutanoate IUPAC Name: 2-(1,3-benzothiazol-5-yl)-2-sulfamoylbutanoate Traditional Name: 2-(1,3-benzothiazol-5-yl)-2-sulfamoyl-butyrate Formula: C11H11N2O4S2- MolecularWeight: 299.34604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)SC=N2)(C(=O)[O-])S(=O)(=O)N

Isomeric SMILES

CCC(C1=CC2=C(C=C1)SC=N2)(C(=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C11H12N2O4S2/c1-2-11(10(14)15,19(12,16)17)7-3-4-9-8(5-7)13-6-18-9/h3-6H,2H2,1H3,(H,14,15)(H2,12,16,17)/p-1