mercury(2+); 1-[(4-methylphenyl)methyl]-4,5-diphenyl-pyridin-1-ium-2-thiolate

Systemtic Name: mercury(2+); 1-[(4-methylphenyl)methyl]-4,5-diphenyl-pyridin-1-ium-2-thiolate Openeye Name: mercuric 4,5-diphenyl-1-(p-tolylmethyl)pyridin-1-ium-2-thiolate CAS Name: mercury(2+); 1-[(4-methylphenyl)methyl]-4,5-diphenyl-2-pyridin-1-iumthiolate IUPAC Name: mercury(2+); 1-[(4-methylphenyl)methyl]-4,5-diphenylpyridin-1-ium-2-thiolate Traditional Name: mercuric 1-(4-methylbenzyl)-4,5-diphenyl-pyridin-1-ium-2-thiolate Formula: C50H42HgN2S2+2 MolecularWeight: 935.60188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=C(C=C(C(=C2)C3=CC=CC=C3)C4=CC=CC=C4)[S-].CC1=CC=C(C=C1)C[N+]2=C(C=C(C(=C2)C3=CC=CC=C3)C4=CC=CC=C4)[S-].[Hg+2]

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=C(C=C(C(=C2)C3=CC=CC=C3)C4=CC=CC=C4)[S-].CC1=CC=C(C=C1)C[N+]2=C(C=C(C(=C2)C3=CC=CC=C3)C4=CC=CC=C4)[S-].[Hg+2]

InChI

InChI=1S/2C25H21NS.Hg/c2*1-19-12-14-20(15-13-19)17-26-18-24(22-10-6-3-7-11-22)23(16-25(26)27)21-8-4-2-5-9-21;/h2*2-16,18H,17H2,1H3;/q;;+2