2-azanyl-6-(4-chlorophenyl)sulfanyl-4-(4-methoxyphenyl)pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-(4-chlorophenyl)sulfanyl-4-(4-methoxyphenyl)pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-(4-chlorophenyl)sulfanyl-4-(4-methoxyphenyl)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[(4-chlorophenyl)thio]-4-(4-methoxyphenyl)pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-(4-chlorophenyl)sulfanyl-4-(4-methoxyphenyl)pyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[(4-chlorophenyl)thio]-4-(4-methoxyphenyl)pyridin-1-ium-3,5-dicarbonitrile Formula: C20H14ClN4OS+ MolecularWeight: 393.86936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=[NH+]C(=C2C#N)SC3=CC=C(C=C3)Cl)N)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=[NH+]C(=C2C#N)SC3=CC=C(C=C3)Cl)N)C#N

InChI

InChI=1S/C20H13ClN4OS/c1-26-14-6-2-12(3-7-14)18-16(10-22)19(24)25-20(17(18)11-23)27-15-8-4-13(21)5-9-15/h2-9H,1H3,(H2,24,25)/p+1