diethyl-[[2-[[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-[[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-[[(3-fluoro-4-methyl-phenyl)carbamothioylamino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-[[[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-[[(3-fluoro-4-methylphenyl)carbamothioylamino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[2-[[(3-fluoro-4-methyl-phenyl)thiocarbamoylamino]methyl]benzyl]ammonium Formula: C20H27FN3S+ MolecularWeight: 360.511883

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=S)NC2=CC(=C(C=C2)C)F

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=S)NC2=CC(=C(C=C2)C)F

InChI

InChI=1S/C20H26FN3S/c1-4-24(5-2)14-17-9-7-6-8-16(17)13-22-20(25)23-18-11-10-15(3)19(21)12-18/h6-12H,4-5,13-14H2,1-3H3,(H2,22,23,25)/p+1