butyl-ethyl-[[5-[[(3-fluorophenyl)carbamothioylamino]methyl]furan-2-yl]methyl]azanium

Systemtic Name: butyl-ethyl-[[5-[[(3-fluorophenyl)carbamothioylamino]methyl]furan-2-yl]methyl]azanium Openeye Name: butyl-ethyl-[[5-[[(3-fluorophenyl)carbamothioylamino]methyl]-2-furyl]methyl]ammonium CAS Name: butyl-ethyl-[[5-[[[(3-fluoroanilino)-sulfanylidenemethyl]amino]methyl]-2-furanyl]methyl]ammonium IUPAC Name: butyl-ethyl-[[5-[[(3-fluorophenyl)carbamothioylamino]methyl]furan-2-yl]methyl]azanium Traditional Name: butyl-ethyl-[[5-[[(3-fluorophenyl)thiocarbamoylamino]methyl]-2-furyl]methyl]ammonium Formula: C19H27FN3OS+ MolecularWeight: 364.500583

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)CC1=CC=C(O1)CNC(=S)NC2=CC(=CC=C2)F

Isomeric SMILES

CCCC[NH+](CC)CC1=CC=C(O1)CNC(=S)NC2=CC(=CC=C2)F

InChI

InChI=1S/C19H26FN3OS/c1-3-5-11-23(4-2)14-18-10-9-17(24-18)13-21-19(25)22-16-8-6-7-15(20)12-16/h6-10,12H,3-5,11,13-14H2,1-2H3,(H2,21,22,25)/p+1