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

Systemtic Name: 2-[(2-propyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid Openeye Name: 2-[(2-propylthiazol-4-yl)methylsulfanyl]propanoic acid CAS Name: 2-[(2-propyl-4-thiazolyl)methylthio]propanoic acid IUPAC Name: 2-[(2-propyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid Traditional Name: 2-[(2-propylthiazol-4-yl)methylthio]propionic acid Formula: C10H15NO2S2 MolecularWeight: 245.3616

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=CS1)CSC(C)C(=O)O

Isomeric SMILES

CCCC1=NC(=CS1)CSC(C)C(=O)O

InChI

InChI=1S/C10H15NO2S2/c1-3-4-9-11-8(6-15-9)5-14-7(2)10(12)13/h6-7H,3-5H2,1-2H3,(H,12,13)