2-[(2-ethoxycarbonyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(2-ethoxycarbonyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid Openeye Name: 2-[(2-ethoxycarbonylthiazol-4-yl)methylsulfanyl]propanoic acid CAS Name: 2-[(2-ethoxycarbonyl-4-thiazolyl)methylthio]propanoic acid IUPAC Name: 2-[(2-ethoxycarbonyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid Traditional Name: 2-[(2-carbethoxythiazol-4-yl)methylthio]propionic acid Formula: C10H13NO4S2 MolecularWeight: 275.34452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)CSC(C)C(=O)O

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)CSC(C)C(=O)O

InChI

InChI=1S/C10H13NO4S2/c1-3-15-10(14)8-11-7(5-17-8)4-16-6(2)9(12)13/h5-6H,3-4H2,1-2H3,(H,12,13)