1-azanyl-3-methylsulfanyl-5-oxidanylidene-N-propan-2-yl-4H-1,2,4-triazol-1-ium-1-carboxamide

Systemtic Name: 1-azanyl-3-methylsulfanyl-5-oxidanylidene-N-propan-2-yl-4H-1,2,4-triazol-1-ium-1-carboxamide Openeye Name: 1-amino-N-isopropyl-3-methylsulfanyl-5-oxo-4H-1,2,4-triazol-1-ium-1-carboxamide CAS Name: 1-amino-3-(methylthio)-5-oxo-N-propan-2-yl-4H-1,2,4-triazol-1-ium-1-carboxamide IUPAC Name: 1-amino-3-methylsulfanyl-5-oxo-N-propan-2-yl-4H-1,2,4-triazol-1-ium-1-carboxamide Traditional Name: 1-amino-N-isopropyl-5-keto-3-(methylthio)-4H-1,2,4-triazol-1-ium-1-carboxamide Formula: C7H14N5O2S+ MolecularWeight: 232.28336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)[N+]1(C(=O)NC(=N1)SC)N

Isomeric SMILES

CC(C)NC(=O)[N+]1(C(=O)NC(=N1)SC)N

InChI

InChI=1S/C7H13N5O2S/c1-4(2)9-6(13)12(8)7(14)10-5(11-12)15-3/h4H,8H2,1-3H3,(H-,9,10,11,13,14)/p+1