2-[(4-methylphenyl)methylsulfanyl]-4,6-diphenyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-4,6-diphenyl-pyridin-1-ium-3-carbonitrile Openeye Name: 4,6-diphenyl-2-(p-tolylmethylsulfanyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-[(4-methylphenyl)methylthio]-4,6-diphenyl-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-4,6-diphenylpyridin-1-ium-3-carbonitrile Traditional Name: 2-[(4-methylbenzyl)thio]-4,6-diphenyl-pyridin-1-ium-3-carbonitrile Formula: C26H21N2S+ MolecularWeight: 393.52334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=C(C(=CC(=[NH+]2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=C(C(=CC(=[NH+]2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C26H20N2S/c1-19-12-14-20(15-13-19)18-29-26-24(17-27)23(21-8-4-2-5-9-21)16-25(28-26)22-10-6-3-7-11-22/h2-16H,18H2,1H3/p+1