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

Systemtic Name: 3-[(2-propyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid Openeye Name: 3-[(2-propylthiazol-4-yl)methylsulfanyl]propanoic acid CAS Name: 3-[(2-propyl-4-thiazolyl)methylthio]propanoic acid IUPAC Name: 3-[(2-propyl-1,3-thiazol-4-yl)methylsulfanyl]propanoic acid Traditional Name: 3-[(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)CSCCC(=O)O

Isomeric SMILES

CCCC1=NC(=CS1)CSCCC(=O)O

InChI

InChI=1S/C10H15NO2S2/c1-2-3-9-11-8(7-15-9)6-14-5-4-10(12)13/h7H,2-6H2,1H3,(H,12,13)