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(2S)-2-azanyl-4-(methylsulfonimidoyl)butanoic acid; pyrazine-2-carboxamide

(2S)-2-azanyl-4-(methylsulfonimidoyl)butanoic acid; pyrazine-2-carboxamide

Systemtic Name:(2S)-2-azanyl-4-(methylsulfonimidoyl)butanoic acid; pyrazine-2-carboxamide
Openeye Name:(2S)-2-amino-4-(methylsulfonimidoyl)butanoic acid; pyrazine-2-carboxamide
CAS Name:(2S)-2-amino-4-(methylsulfonimidoyl)butanoic acid; 2-pyrazinecarboxamide
IUPAC Name:(2S)-2-amino-4-(methylsulfonimidoyl)butanoic acid; pyrazine-2-carboxamide
Traditional Name:(2S)-2-amino-4-(methylsulfonimidoyl)butyric acid; pyrazinamide
Formula: C10H17N5O4S
MolecularWeight: 303.33808
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Descriptors Computed from Structure

Canonical SMILES:

CS(=N)(=O)CCC(C(=O)O)N.C1=CN=C(C=N1)C(=O)N


Isomeric SMILES

CS(=N)(=O)CC[C@@H](C(=O)O)N.C1=CN=C(C=N1)C(=O)N


InChI

InChI=1S/C5H5N3O.C5H12N2O3S/c6-5(9)4-3-7-1-2-8-4;1-11(7,10)3-2-4(6)5(8)9/h1-3H,(H2,6,9);4,7H,2-3,6H2,1H3,(H,8,9)/t;4-,11?/m.0/s1


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