2-azanyl-3-[(1-methylpyrazol-4-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(1-methylpyrazol-4-yl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(1-methylpyrazol-4-yl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(1-methyl-4-pyrazolyl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(1-methylpyrazol-4-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(1-methylpyrazol-4-yl)methylthio]propionic acid Formula: C8H13N3O2S MolecularWeight: 215.27272

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CSCC(C(=O)O)N

Isomeric SMILES

CN1C=C(C=N1)CSCC(C(=O)O)N

InChI

InChI=1S/C8H13N3O2S/c1-11-3-6(2-10-11)4-14-5-7(9)8(12)13/h2-3,7H,4-5,9H2,1H3,(H,12,13)