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Isonicotinoyl aminoguanidine

HCID 208571
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Basic information

CAS
32451-24-4
Standard SMILES
NC(N)=NNC(=O)c1ccncc1.NC(N)=NNC(=O)c1ccncc1.O=S(=O)(O)O
InChIKey
WUCHYDIFEAQHJF-UHFFFAOYSA-N
Molecular formula
C14H20N10O6S
Average molar mass
456.44 g/mol
Monoisotopic mass
456.12879957

Names & identifiers

Preferred name
Isonicotinoyl aminoguanidine
IUPAC
bis(N-(diaminomethylideneamino)pyridine-4-carboxamide);sulfuric acid

Names & synonyms

Isonicotinoyl aminoguanidine32451-24-4RefChem:10876242-(Aminoiminomethyl)hydrazide 4-pyridinecarboxylic acid sulfate (2:1)DTXSID909542054-Pyridinecarboxylic acid, 2-(aminoiminomethyl)hydrazide, sulfate (2:1)N-Carbamimidoylpyridine-4-carbohydrazonic acid--sulfuric acid (2/1)

Database identifiers

CAS
32451-24-4
PubChem CID
208571
DTXSID
DTXSID90954205

Properties

Computed structural properties

Topological polar surface area
296 Ų
Hydrogen bond donors
8
Hydrogen bond acceptors
10
Rotatable bonds
4
Heavy atoms
31
Formal charge
0
Complexity
286

Related reactions

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Compound notes

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