(Z)-1-ethoxy-2-[1-(4-methylphenyl)-4,6-diphenyl-pyridin-1-ium-2-yl]sulfanyl-ethenolate

Systemtic Name: (Z)-1-ethoxy-2-[1-(4-methylphenyl)-4,6-diphenyl-pyridin-1-ium-2-yl]sulfanyl-ethenolate Openeye Name: (Z)-2-[4,6-diphenyl-1-(p-tolyl)pyridin-1-ium-2-yl]sulfanyl-1-ethoxy-ethenolate CAS Name: (Z)-1-ethoxy-2-[[1-(4-methylphenyl)-4,6-diphenyl-2-pyridin-1-iumyl]thio]ethenolate IUPAC Name: (Z)-1-ethoxy-2-[1-(4-methylphenyl)-4,6-diphenylpyridin-1-ium-2-yl]sulfanylethenolate Traditional Name: (Z)-2-[[4,6-diphenyl-1-(p-tolyl)pyridin-1-ium-2-yl]thio]-1-ethoxy-ethenolate Formula: C28H25NO2S MolecularWeight: 439.5686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=CSC1=CC(=CC(=[N+]1C2=CC=C(C=C2)C)C3=CC=CC=C3)C4=CC=CC=C4)[O-]

Isomeric SMILES

CCO/C(=C\SC1=CC(=CC(=[N+]1C2=CC=C(C=C2)C)C3=CC=CC=C3)C4=CC=CC=C4)/[O-]

InChI

InChI=1S/C28H25NO2S/c1-3-31-28(30)20-32-27-19-24(22-10-6-4-7-11-22)18-26(23-12-8-5-9-13-23)29(27)25-16-14-21(2)15-17-25/h4-20H,3H2,1-2H3/b28-20-