2-(1,3-thiazol-4-ylmethyl)-3H-benzimidazole-5-sulfonic acid

Systemtic Name: 2-(1,3-thiazol-4-ylmethyl)-3H-benzimidazole-5-sulfonic acid Openeye Name: 2-(thiazol-4-ylmethyl)-3H-benzimidazole-5-sulfonic acid CAS Name: 2-(4-thiazolylmethyl)-3H-benzimidazole-5-sulfonic acid IUPAC Name: 2-(1,3-thiazol-4-ylmethyl)-3H-benzimidazole-5-sulfonic acid Traditional Name: 2-(thiazol-4-ylmethyl)-3H-benzimidazole-5-sulfonic acid Formula: C11H9N3O3S2 MolecularWeight: 295.33746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)O)NC(=N2)CC3=CSC=N3

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)O)NC(=N2)CC3=CSC=N3

InChI

InChI=1S/C11H9N3O3S2/c15-19(16,17)8-1-2-9-10(4-8)14-11(13-9)3-7-5-18-6-12-7/h1-2,4-6H,3H2,(H,13,14)(H,15,16,17)