3-[(1-ethyl-5-methyl-pyrazol-4-yl)methylsulfanyl]propanoic acid

Systemtic Name: 3-[(1-ethyl-5-methyl-pyrazol-4-yl)methylsulfanyl]propanoic acid Openeye Name: 3-[(1-ethyl-5-methyl-pyrazol-4-yl)methylsulfanyl]propanoic acid CAS Name: 3-[(1-ethyl-5-methyl-4-pyrazolyl)methylthio]propanoic acid IUPAC Name: 3-[(1-ethyl-5-methylpyrazol-4-yl)methylsulfanyl]propanoic acid Traditional Name: 3-[(1-ethyl-5-methyl-pyrazol-4-yl)methylthio]propionic acid Formula: C10H16N2O2S MolecularWeight: 228.31124

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CSCCC(=O)O)C

Isomeric SMILES

CCN1C(=C(C=N1)CSCCC(=O)O)C

InChI

InChI=1S/C10H16N2O2S/c1-3-12-8(2)9(6-11-12)7-15-5-4-10(13)14/h6H,3-5,7H2,1-2H3,(H,13,14)