[1-[[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]methyl]cyclohexyl]-dimethyl-azanium

Systemtic Name: [1-[[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]methyl]cyclohexyl]-dimethyl-azanium Openeye Name: [1-[[(3-chloro-4-fluoro-phenyl)carbamothioylamino]methyl]cyclohexyl]-dimethyl-ammonium CAS Name: [1-[[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]amino]methyl]cyclohexyl]-dimethylammonium IUPAC Name: [1-[[(3-chloro-4-fluorophenyl)carbamothioylamino]methyl]cyclohexyl]-dimethylazanium Traditional Name: [1-[[(3-chloro-4-fluoro-phenyl)thiocarbamoylamino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C16H24ClFN3S+ MolecularWeight: 344.898263

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)CNC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C[NH+](C)C1(CCCCC1)CNC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H23ClFN3S/c1-21(2)16(8-4-3-5-9-16)11-19-15(22)20-12-6-7-14(18)13(17)10-12/h6-7,10H,3-5,8-9,11H2,1-2H3,(H2,19,20,22)/p+1