1-ethyl-2,4,6-triphenyl-pyridin-1-ium thiocyanate

Systemtic Name: 1-ethyl-2,4,6-triphenyl-pyridin-1-ium thiocyanate Openeye Name: 1-ethyl-2,4,6-triphenyl-pyridin-1-ium thiocyanate CAS Name: 1-ethyl-2,4,6-triphenylpyridin-1-ium thiocyanate IUPAC Name: 1-ethyl-2,4,6-triphenylpyridin-1-ium thiocyanate Traditional Name: 1-ethyl-2,4,6-triphenyl-pyridin-1-ium thiocyanate Formula: C26H22N2S MolecularWeight: 394.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C(#N)[S-]

Isomeric SMILES

CC[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C(#N)[S-]

InChI

InChI=1S/C25H22N.CHNS/c1-2-26-24(21-14-8-4-9-15-21)18-23(20-12-6-3-7-13-20)19-25(26)22-16-10-5-11-17-22;2-1-3/h3-19H,2H2,1H3;3H/q+1;/p-1