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

Systemtic Name: 2-[(2-ethoxycarbonyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(2-ethoxycarbonylthiazol-4-yl)methylsulfanyl]acetic acid CAS Name: 2-[(2-ethoxycarbonyl-4-thiazolyl)methylthio]acetic acid IUPAC Name: 2-[(2-ethoxycarbonyl-1,3-thiazol-4-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(2-carbethoxythiazol-4-yl)methylthio]acetic acid Formula: C9H11NO4S2 MolecularWeight: 261.31794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)CSCC(=O)O

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)CSCC(=O)O

InChI

InChI=1S/C9H11NO4S2/c1-2-14-9(13)8-10-6(4-16-8)3-15-5-7(11)12/h4H,2-3,5H2,1H3,(H,11,12)