2-azanyl-4-(4-fluorophenyl)-6-[(4-fluorophenyl)methylsulfanyl]pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(4-fluorophenyl)-6-[(4-fluorophenyl)methylsulfanyl]pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-4-(4-fluorophenyl)-6-[(4-fluorophenyl)methylsulfanyl]pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-4-(4-fluorophenyl)-6-[(4-fluorophenyl)methylthio]pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(4-fluorophenyl)-6-[(4-fluorophenyl)methylsulfanyl]pyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[(4-fluorobenzyl)thio]-4-(4-fluorophenyl)pyridin-1-ium-3,5-dicarbonitrile Formula: C20H13F2N4S+ MolecularWeight: 379.405826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=C(C(=C(C(=[NH+]2)N)C#N)C3=CC=C(C=C3)F)C#N)F

Isomeric SMILES

C1=CC(=CC=C1CSC2=C(C(=C(C(=[NH+]2)N)C#N)C3=CC=C(C=C3)F)C#N)F

InChI

InChI=1S/C20H12F2N4S/c21-14-5-1-12(2-6-14)11-27-20-17(10-24)18(16(9-23)19(25)26-20)13-3-7-15(22)8-4-13/h1-8H,11H2,(H2,25,26)/p+1