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

Systemtic Name: 4-methylsulfonyl-2-[(6-oxidanylidene-1H-pyrazin-3-yl)carbonylamino]butanoic acid Openeye Name: 4-methylsulfonyl-2-[(6-oxo-1H-pyrazine-3-carbonyl)amino]butanoic acid CAS Name: 4-methylsulfonyl-2-[[oxo-(6-oxo-1H-pyrazin-3-yl)methyl]amino]butanoic acid IUPAC Name: 4-methylsulfonyl-2-[(6-oxo-1H-pyrazine-3-carbonyl)amino]butanoic acid Traditional Name: 2-[(6-keto-1H-pyrazine-3-carbonyl)amino]-4-mesyl-butyric acid Formula: C10H13N3O6S MolecularWeight: 303.29172

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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)CCC(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)