2-(thiolan-2-yl)-3H-benzimidazole-5-sulfonic acid

Systemtic Name: 2-(thiolan-2-yl)-3H-benzimidazole-5-sulfonic acid Openeye Name: 2-tetrahydrothiophen-2-yl-3H-benzimidazole-5-sulfonic acid CAS Name: 2-(2-thiolanyl)-3H-benzimidazole-5-sulfonic acid IUPAC Name: 2-(thiolan-2-yl)-3H-benzimidazole-5-sulfonic acid Traditional Name: 2-tetrahydrothiophen-2-yl-3H-benzimidazole-5-sulfonic acid Formula: C11H12N2O3S2 MolecularWeight: 284.35458

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(SC1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O

Isomeric SMILES

C1CC(SC1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C11H12N2O3S2/c14-18(15,16)7-3-4-8-9(6-7)13-11(12-8)10-2-1-5-17-10/h3-4,6,10H,1-2,5H2,(H,12,13)(H,14,15,16)