[4-[[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[[2-[(4-chlorophenyl)thio]ethylamino]-sulfanylidenemethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[2-[(4-chlorophenyl)thio]ethylthiocarbamoylamino]methyl]benzyl]-dimethyl-ammonium Formula: C19H25ClN3S2+ MolecularWeight: 395.0049

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=S)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=S)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H24ClN3S2/c1-23(2)14-16-5-3-15(4-6-16)13-22-19(24)21-11-12-25-18-9-7-17(20)8-10-18/h3-10H,11-14H2,1-2H3,(H2,21,22,24)/p+1