2-[6-(2-azanylethynylsulfamoyl)-2-sulfanylidene-3H-benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[6-(2-azanylethynylsulfamoyl)-2-sulfanylidene-3H-benzimidazol-1-yl]ethanoic acid Openeye Name: 2-[6-(2-aminoethynylsulfamoyl)-2-thioxo-3H-benzimidazol-1-yl]acetic acid CAS Name: 2-[6-(2-aminoethynylsulfamoyl)-2-sulfanylidene-3H-benzimidazol-1-yl]acetic acid IUPAC Name: 2-[6-(2-aminoethynylsulfamoyl)-2-sulfanylidene-3H-benzimidazol-1-yl]acetic acid Traditional Name: 2-[6-(2-aminoethynylsulfamoyl)-2-thioxo-3H-benzimidazol-1-yl]acetic acid Formula: C11H10N4O4S2 MolecularWeight: 326.3515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)NC#CN)N(C(=S)N2)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)NC#CN)N(C(=S)N2)CC(=O)O

InChI

InChI=1S/C11H10N4O4S2/c12-3-4-13-21(18,19)7-1-2-8-9(5-7)15(6-10(16)17)11(20)14-8/h1-2,5,13H,6,12H2,(H,14,20)(H,16,17)