2-(sulfanylmethyl)-3H-benzimidazole-5-sulfonic acid

Systemtic Name: 2-(sulfanylmethyl)-3H-benzimidazole-5-sulfonic acid Openeye Name: 2-(sulfanylmethyl)-3H-benzimidazole-5-sulfonic acid CAS Name: 2-(mercaptomethyl)-3H-benzimidazole-5-sulfonic acid IUPAC Name: 2-(sulfanylmethyl)-3H-benzimidazole-5-sulfonic acid Traditional Name: 2-(mercaptomethyl)-3H-benzimidazole-5-sulfonic acid Formula: C8H8N2O3S2 MolecularWeight: 244.29072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)O)NC(=N2)CS

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)O)NC(=N2)CS

InChI

InChI=1S/C8H8N2O3S2/c11-15(12,13)5-1-2-6-7(3-5)10-8(4-14)9-6/h1-3,14H,4H2,(H,9,10)(H,11,12,13)