4-imidazol-1-yl-3-sulfanyl-butanoic acid

Systemtic Name: 4-imidazol-1-yl-3-sulfanyl-butanoic acid Openeye Name: 4-imidazol-1-yl-3-sulfanyl-butanoic acid CAS Name: 4-(1-imidazolyl)-3-mercaptobutanoic acid IUPAC Name: 4-imidazol-1-yl-3-sulfanylbutanoic acid Traditional Name: 4-imidazol-1-yl-3-mercapto-butyric acid Formula: C7H10N2O2S MolecularWeight: 186.2315

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CC(CC(=O)O)S

Isomeric SMILES

C1=CN(C=N1)CC(CC(=O)O)S

InChI

InChI=1S/C7H10N2O2S/c10-7(11)3-6(12)4-9-2-1-8-5-9/h1-2,5-6,12H,3-4H2,(H,10,11)