2-[methyl(thiolan-3-yl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 2-[methyl(thiolan-3-yl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 2-[methyl(tetrahydrothiophen-3-yl)amino]-5-sulfamoyl-benzoic acid CAS Name: 2-[methyl(3-thiolanyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 2-[methyl(thiolan-3-yl)amino]-5-sulfamoylbenzoic acid Traditional Name: 2-[methyl(tetrahydrothiophen-3-yl)amino]-5-sulfamoyl-benzoic acid Formula: C12H16N2O4S2 MolecularWeight: 316.39644

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCSC1)C2=C(C=C(C=C2)S(=O)(=O)N)C(=O)O

Isomeric SMILES

CN(C1CCSC1)C2=C(C=C(C=C2)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C12H16N2O4S2/c1-14(8-4-5-19-7-8)11-3-2-9(20(13,17)18)6-10(11)12(15)16/h2-3,6,8H,4-5,7H2,1H3,(H,15,16)(H2,13,17,18)