1-(2-imidazol-1-ylphenyl)-3-sulfanyl-butane-1,1,2,2-tetrol

Systemtic Name: 1-(2-imidazol-1-ylphenyl)-3-sulfanyl-butane-1,1,2,2-tetrol Openeye Name: 1-(2-imidazol-1-ylphenyl)-3-sulfanyl-butane-1,1,2,2-tetrol CAS Name: 1-[2-(1-imidazolyl)phenyl]-3-mercaptobutane-1,1,2,2-tetrol IUPAC Name: 1-(2-imidazol-1-ylphenyl)-3-sulfanylbutane-1,1,2,2-tetrol Traditional Name: 1-(2-imidazol-1-ylphenyl)-3-mercapto-butane-1,1,2,2-tetrol Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C1=CC=CC=C1N2C=CN=C2)(O)O)(O)O)S

Isomeric SMILES

CC(C(C(C1=CC=CC=C1N2C=CN=C2)(O)O)(O)O)S

InChI

InChI=1S/C13H16N2O4S/c1-9(20)12(16,17)13(18,19)10-4-2-3-5-11(10)15-7-6-14-8-15/h2-9,16-20H,1H3