2-azanyl-3-[(1,3,5-trimethylpyrazol-4-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(1,3,5-trimethylpyrazol-4-yl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(1,3,5-trimethylpyrazol-4-yl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(1,3,5-trimethyl-4-pyrazolyl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(1,3,5-trimethylpyrazol-4-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(1,3,5-trimethylpyrazol-4-yl)methylthio]propionic acid Formula: C10H17N3O2S MolecularWeight: 243.32588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CSCC(C(=O)O)N

Isomeric SMILES

CC1=C(C(=NN1C)C)CSCC(C(=O)O)N

InChI

InChI=1S/C10H17N3O2S/c1-6-8(7(2)13(3)12-6)4-16-5-9(11)10(14)15/h9H,4-5,11H2,1-3H3,(H,14,15)