2-acetamido-3-[(5-ethoxycarbonyl-1H-imidazol-4-yl)sulfanyl]propanoic acid

Systemtic Name: 2-acetamido-3-[(5-ethoxycarbonyl-1H-imidazol-4-yl)sulfanyl]propanoic acid Openeye Name: 2-acetamido-3-[(5-ethoxycarbonyl-1H-imidazol-4-yl)sulfanyl]propanoic acid CAS Name: 2-acetamido-3-[(5-ethoxycarbonyl-1H-imidazol-4-yl)thio]propanoic acid IUPAC Name: 2-acetamido-3-[(5-ethoxycarbonyl-1H-imidazol-4-yl)sulfanyl]propanoic acid Traditional Name: 2-acetamido-3-[(5-carbethoxy-1H-imidazol-4-yl)thio]propionic acid Formula: C11H15N3O5S MolecularWeight: 301.3189

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=CN1)SCC(C(=O)O)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N=CN1)SCC(C(=O)O)NC(=O)C

InChI

InChI=1S/C11H15N3O5S/c1-3-19-11(18)8-9(13-5-12-8)20-4-7(10(16)17)14-6(2)15/h5,7H,3-4H2,1-2H3,(H,12,13)(H,14,15)(H,16,17)