2-azanyl-3-(3-methyl-5-sulfanyl-imidazol-4-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(3-methyl-5-sulfanyl-imidazol-4-yl)propanoic acid Openeye Name: 2-amino-3-(3-methyl-5-sulfanyl-imidazol-4-yl)propanoic acid CAS Name: 2-amino-3-(5-mercapto-3-methyl-4-imidazolyl)propanoic acid IUPAC Name: 2-amino-3-(3-methyl-5-sulfanylimidazol-4-yl)propanoic acid Traditional Name: 2-amino-3-(5-mercapto-3-methyl-imidazol-4-yl)propionic acid Formula: C7H11N3O2S MolecularWeight: 201.24614

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1CC(C(=O)O)N)S

Isomeric SMILES

CN1C=NC(=C1CC(C(=O)O)N)S

InChI

InChI=1S/C7H11N3O2S/c1-10-3-9-6(13)5(10)2-4(8)7(11)12/h3-4,13H,2,8H2,1H3,(H,11,12)