N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine CAS Name: N-[4-(difluoromethylthio)phenyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine Traditional Name: [4-(difluoromethylthio)phenyl]-(1-pyrrolin-1-ium-2-yl)amine Formula: C11H13F2N2S+ MolecularWeight: 243.296126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NC2=CC=C(C=C2)SC(F)F

Isomeric SMILES

C1CC(=[NH+]C1)NC2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C11H12F2N2S/c12-11(13)16-9-5-3-8(4-6-9)15-10-2-1-7-14-10/h3-6,11H,1-2,7H2,(H,14,15)/p+1