3-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-N-pyridin-1-ium-2-yl-prop-2-enamide

Systemtic Name: 3-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-N-pyridin-1-ium-2-yl-prop-2-enamide Openeye Name: 3-[4-(difluoromethylsulfanyl)phenyl]-N-pyridin-1-ium-2-yl-prop-2-enamide CAS Name: 3-[4-(difluoromethylthio)phenyl]-N-(2-pyridin-1-iumyl)-2-propenamide IUPAC Name: 3-[4-(difluoromethylsulfanyl)phenyl]-N-pyridin-1-ium-2-ylprop-2-enamide Traditional Name: 3-[4-(difluoromethylthio)phenyl]-N-pyridin-1-ium-2-yl-acrylamide Formula: C15H13F2N2OS+ MolecularWeight: 307.338326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NC(=O)C=CC2=CC=C(C=C2)SC(F)F

Isomeric SMILES

C1=CC=[NH+]C(=C1)NC(=O)C=CC2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C15H12F2N2OS/c16-15(17)21-12-7-4-11(5-8-12)6-9-14(20)19-13-3-1-2-10-18-13/h1-10,15H,(H,18,19,20)/p+1