(2S)-4-methylsulfanyl-2-(2-pyrazol-1-ylethanoylamino)butanoate

Systemtic Name: (2S)-4-methylsulfanyl-2-(2-pyrazol-1-ylethanoylamino)butanoate Openeye Name: (2S)-4-methylsulfanyl-2-[(2-pyrazol-1-ylacetyl)amino]butanoate CAS Name: (2S)-4-(methylthio)-2-[[1-oxo-2-(1-pyrazolyl)ethyl]amino]butanoate IUPAC Name: (2S)-4-methylsulfanyl-2-[(2-pyrazol-1-ylacetyl)amino]butanoate Traditional Name: (2S)-4-(methylthio)-2-[(2-pyrazol-1-ylacetyl)amino]butyrate Formula: C10H14N3O3S- MolecularWeight: 256.30146

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)CN1C=CC=N1

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)CN1C=CC=N1

InChI

InChI=1S/C10H15N3O3S/c1-17-6-3-8(10(15)16)12-9(14)7-13-5-2-4-11-13/h2,4-5,8H,3,6-7H2,1H3,(H,12,14)(H,15,16)/p-1/t8-/m0/s1