(1-oxidanidylpyridin-1-ium-4-yl) carbamimidothioate

Systemtic Name: (1-oxidanidylpyridin-1-ium-4-yl) carbamimidothioate Openeye Name: 2-(1-oxidopyridin-1-ium-4-yl)isothiourea CAS Name: carbamimidothioic acid (1-oxido-4-pyridin-1-iumyl) ester IUPAC Name: (1-oxidopyridin-1-ium-4-yl) carbamimidothioate Traditional Name: 2-(1-oxidopyridin-1-ium-4-yl)isothiourea Formula: C6H7N3OS MolecularWeight: 169.20428

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1SC(=N)N)[O-]

Isomeric SMILES

C1=C[N+](=CC=C1SC(=N)N)[O-]

InChI

InChI=1S/C6H7N3OS/c7-6(8)11-5-1-3-9(10)4-2-5/h1-4H,(H3,7,8)