2-azanyl-3-[[3-(trifluoromethyl)pyrazol-1-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[[3-(trifluoromethyl)pyrazol-1-yl]methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[[3-(trifluoromethyl)pyrazol-1-yl]methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[[3-(trifluoromethyl)-1-pyrazolyl]methylthio]propanoic acid IUPAC Name: 2-amino-3-[[3-(trifluoromethyl)pyrazol-1-yl]methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[[3-(trifluoromethyl)pyrazol-1-yl]methylthio]propionic acid Formula: C8H10F3N3O2S MolecularWeight: 269.24411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1C(F)(F)F)CSCC(C(=O)O)N

Isomeric SMILES

C1=CN(N=C1C(F)(F)F)CSCC(C(=O)O)N

InChI

InChI=1S/C8H10F3N3O2S/c9-8(10,11)6-1-2-14(13-6)4-17-3-5(12)7(15)16/h1-2,5H,3-4,12H2,(H,15,16)