butyl-[[5-[[(5-chloranyl-2-methoxy-phenyl)carbamothioylamino]methyl]furan-2-yl]methyl]-ethyl-azanium

Systemtic Name: butyl-[[5-[[(5-chloranyl-2-methoxy-phenyl)carbamothioylamino]methyl]furan-2-yl]methyl]-ethyl-azanium Openeye Name: butyl-[[5-[[(5-chloro-2-methoxy-phenyl)carbamothioylamino]methyl]-2-furyl]methyl]-ethyl-ammonium CAS Name: butyl-[[5-[[[(5-chloro-2-methoxyanilino)-sulfanylidenemethyl]amino]methyl]-2-furanyl]methyl]-ethylammonium IUPAC Name: butyl-[[5-[[(5-chloro-2-methoxyphenyl)carbamothioylamino]methyl]furan-2-yl]methyl]-ethylazanium Traditional Name: butyl-[[5-[[(5-chloro-2-methoxy-phenyl)thiocarbamoylamino]methyl]-2-furyl]methyl]-ethyl-ammonium Formula: C20H29ClN3O2S+ MolecularWeight: 410.98116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28ClN3O2S/c1-4-6-11-24(5-2)14-17-9-8-16(26-17)13-22-20(27)23-18-12-15(21)7-10-19(18)25-3/h7-10,12H,4-6,11,13-14H2,1-3H3,(H2,22,23,27)/p+1