6-(3-azaniumylpropylsulfanyl)-5-oxidanylidene-2H-1,2,4-triazin-3-olate

Systemtic Name: 6-(3-azaniumylpropylsulfanyl)-5-oxidanylidene-2H-1,2,4-triazin-3-olate Openeye Name: 6-(3-azaniumylpropylsulfanyl)-5-oxo-2H-1,2,4-triazin-3-olate CAS Name: 6-(3-ammoniopropylthio)-5-oxo-2H-1,2,4-triazin-3-olate IUPAC Name: 6-(3-azaniumylpropylsulfanyl)-5-oxo-2H-1,2,4-triazin-3-olate Traditional Name: 6-(3-ammoniopropylthio)-5-keto-2H-1,2,4-triazin-3-olate Formula: C6H10N4O2S MolecularWeight: 202.2342

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Descriptors Computed from Structure

Canonical SMILES:

C(C[NH3+])CSC1=NNC(=NC1=O)[O-]

Isomeric SMILES

C(C[NH3+])CSC1=NNC(=NC1=O)[O-]

InChI

InChI=1S/C6H10N4O2S/c7-2-1-3-13-5-4(11)8-6(12)10-9-5/h1-3,7H2,(H2,8,10,11,12)