5-phenylsulfanylimidazole-1-sulfonic acid

Systemtic Name: 5-phenylsulfanylimidazole-1-sulfonic acid Openeye Name: 5-phenylsulfanylimidazole-1-sulfonic acid CAS Name: 5-(phenylthio)-1-imidazolesulfonic acid IUPAC Name: 5-phenylsulfanylimidazole-1-sulfonic acid Traditional Name: 5-(phenylthio)imidazole-1-sulfonic acid Formula: C9H8N2O3S2 MolecularWeight: 256.30142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CN=CN2S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CN=CN2S(=O)(=O)O

InChI

InChI=1S/C9H8N2O3S2/c12-16(13,14)11-7-10-6-9(11)15-8-4-2-1-3-5-8/h1-7H,(H,12,13,14)