(2S)-4-methylsulfonyl-2-[(6-oxidanylidene-1H-pyrazin-3-yl)carbonylamino]butanoate

Systemtic Name: (2S)-4-methylsulfonyl-2-[(6-oxidanylidene-1H-pyrazin-3-yl)carbonylamino]butanoate Openeye Name: (2S)-4-methylsulfonyl-2-[(6-oxo-1H-pyrazine-3-carbonyl)amino]butanoate CAS Name: (2S)-4-methylsulfonyl-2-[[oxo-(6-oxo-1H-pyrazin-3-yl)methyl]amino]butanoate IUPAC Name: (2S)-4-methylsulfonyl-2-[(6-oxo-1H-pyrazine-3-carbonyl)amino]butanoate Traditional Name: (2S)-2-[(6-keto-1H-pyrazine-3-carbonyl)amino]-4-mesyl-butyrate Formula: C10H12N3O6S- MolecularWeight: 302.28378

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)[O-])NC(=O)C1=CNC(=O)C=N1

Isomeric SMILES

CS(=O)(=O)CC[C@@H](C(=O)[O-])NC(=O)C1=CNC(=O)C=N1

InChI

InChI=1S/C10H13N3O6S/c1-20(18,19)3-2-6(10(16)17)13-9(15)7-4-12-8(14)5-11-7/h4-6H,2-3H2,1H3,(H,12,14)(H,13,15)(H,16,17)/p-1/t6-/m0/s1