2-(6-azanyl-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N-[2,6-bis(fluoranyl)phenyl]ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N-[2,6-bis(fluoranyl)phenyl]ethanamide Openeye Name: 2-(6-amino-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N-(2,6-difluorophenyl)acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridin-1-iumyl)thio]-N-(2,6-difluorophenyl)acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-1-ium-2-yl)sulfanyl-N-(2,6-difluorophenyl)acetamide Traditional Name: 2-[(6-amino-3,5-dicyano-pyridin-1-ium-2-yl)thio]-N-(2,6-difluorophenyl)acetamide Formula: C15H10F2N5OS+ MolecularWeight: 346.334606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)NC(=O)CSC2=C(C=C(C(=[NH+]2)N)C#N)C#N)F

Isomeric SMILES

C1=CC(=C(C(=C1)F)NC(=O)CSC2=C(C=C(C(=[NH+]2)N)C#N)C#N)F

InChI

InChI=1S/C15H9F2N5OS/c16-10-2-1-3-11(17)13(10)21-12(23)7-24-15-9(6-19)4-8(5-18)14(20)22-15/h1-4H,7H2,(H2,20,22)(H,21,23)/p+1