2-(1H-benzimidazol-2-ylsulfanyl)ethanesulfonate

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)ethanesulfonate Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)ethanesulfonate CAS Name: 2-(1H-benzimidazol-2-ylthio)ethanesulfonate IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)ethanesulfonate Traditional Name: 2-(1H-benzimidazol-2-ylthio)ethanesulfonate Formula: C9H9N2O3S2- MolecularWeight: 257.30936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCS(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCS(=O)(=O)[O-]

InChI

InChI=1S/C9H10N2O3S2/c12-16(13,14)6-5-15-9-10-7-3-1-2-4-8(7)11-9/h1-4H,5-6H2,(H,10,11)(H,12,13,14)/p-1