2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]carbamothioylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]carbamothioylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-(difluoromethylsulfanyl)phenyl]carbamothioylamino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-(difluoromethylthio)anilino]-sulfanylidenemethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-(difluoromethylsulfanyl)phenyl]carbamothioylamino]ethyl-diethylazanium Traditional Name: 2-[[4-(difluoromethylthio)phenyl]thiocarbamoylamino]ethyl-diethyl-ammonium Formula: C14H22F2N3S2+ MolecularWeight: 334.471386

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=S)NC1=CC=C(C=C1)SC(F)F

Isomeric SMILES

CC[NH+](CC)CCNC(=S)NC1=CC=C(C=C1)SC(F)F

InChI

InChI=1S/C14H21F2N3S2/c1-3-19(4-2)10-9-17-14(20)18-11-5-7-12(8-6-11)21-13(15)16/h5-8,13H,3-4,9-10H2,1-2H3,(H2,17,18,20)/p+1