(2-azanyl-6-sulfanylidene-3,9-dihydropurine-1,7-diium-7-yl)-hexyl-mercury

Systemtic Name: (2-azanyl-6-sulfanylidene-3,9-dihydropurine-1,7-diium-7-yl)-hexyl-mercury Openeye Name: (2-amino-6-thioxo-3,9-dihydropurine-1,7-diium-7-yl)-hexyl-mercury CAS Name: (2-amino-6-sulfanylidene-3,9-dihydropurine-1,7-diium-7-yl)-hexylmercury IUPAC Name: (2-amino-6-sulfanylidene-3,9-dihydropurine-1,7-diium-7-yl)-hexylmercury Traditional Name: (2-amino-6-thioxo-3,9-dihydropurine-1,7-diium-7-yl)-hexyl-mercury Formula: C11H19HgN5S+2 MolecularWeight: 453.95706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[Hg][N+]1=CNC2=C1C(=S)[NH+]=C(N2)N

Isomeric SMILES

CCCCCC[Hg][N+]1=CNC2=C1C(=S)[NH+]=C(N2)N

InChI

InChI=1S/C6H13.C5H5N5S.Hg/c1-3-5-6-4-2;6-5-9-3-2(4(11)10-5)7-1-8-3;/h1,3-6H2,2H3;1H,(H4,6,7,8,9,10,11);/q;;+1/p+1