2-[[(4-chlorophenyl)methyl-methyl-carbamothioyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(4-chlorophenyl)methyl-methyl-carbamothioyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(4-chlorophenyl)methyl-methyl-carbamothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[(4-chlorophenyl)methyl-methylamino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(4-chlorophenyl)methyl-methylcarbamothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(4-chlorobenzyl)-methyl-thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C13H21ClN3S+ MolecularWeight: 286.84394

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)N(C)CC1=CC=C(C=C1)Cl

Isomeric SMILES

C[NH+](C)CCNC(=S)N(C)CC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H20ClN3S/c1-16(2)9-8-15-13(18)17(3)10-11-4-6-12(14)7-5-11/h4-7H,8-10H2,1-3H3,(H,15,18)/p+1