2-[[5-chloranyl-2-(4-methylphenoxy)phenyl]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-chloranyl-2-(4-methylphenoxy)phenyl]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-chloro-2-(4-methylphenoxy)phenyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-chloro-2-(4-methylphenoxy)anilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-chloro-2-(4-methylphenoxy)phenyl]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[5-chloro-2-(4-methylphenoxy)phenyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C18H23ClN3OS+ MolecularWeight: 364.91272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=S)NCC[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=S)NCC[NH+](C)C

InChI

InChI=1S/C18H22ClN3OS/c1-13-4-7-15(8-5-13)23-17-9-6-14(19)12-16(17)21-18(24)20-10-11-22(2)3/h4-9,12H,10-11H2,1-3H3,(H2,20,21,24)/p+1