(2S)-4-methylsulfanyl-2-(pyrazin-2-ylcarbonylamino)butanoic acid

Systemtic Name: (2S)-4-methylsulfanyl-2-(pyrazin-2-ylcarbonylamino)butanoic acid Openeye Name: (2S)-4-methylsulfanyl-2-(pyrazine-2-carbonylamino)butanoic acid CAS Name: (2S)-4-(methylthio)-2-[[oxo(2-pyrazinyl)methyl]amino]butanoic acid IUPAC Name: (2S)-4-methylsulfanyl-2-(pyrazine-2-carbonylamino)butanoic acid Traditional Name: (2S)-4-(methylthio)-2-(pyrazinoylamino)butyric acid Formula: C10H13N3O3S MolecularWeight: 255.29352

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=NC=CN=C1

Isomeric SMILES

CSCC[C@@H](C(=O)O)NC(=O)C1=NC=CN=C1

InChI

InChI=1S/C10H13N3O3S/c1-17-5-2-7(10(15)16)13-9(14)8-6-11-3-4-12-8/h3-4,6-7H,2,5H2,1H3,(H,13,14)(H,15,16)/t7-/m0/s1