3-(carboxymethylsulfanyl)-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 3-(carboxymethylsulfanyl)-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 3-(carboxymethylsulfanyl)-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 3-(carboxymethylthio)-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 3-(carboxymethylsulfanyl)-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 3-(carboxymethylthio)-3-(1H-imidazol-5-yl)propionic acid Formula: C8H10N2O4S MolecularWeight: 230.241

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)C(CC(=O)O)SCC(=O)O

Isomeric SMILES

C1=C(NC=N1)C(CC(=O)O)SCC(=O)O

InChI

InChI=1S/C8H10N2O4S/c11-7(12)1-6(15-3-8(13)14)5-2-9-4-10-5/h2,4,6H,1,3H2,(H,9,10)(H,11,12)(H,13,14)