[3-[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[[2-[(4-chlorophenyl)thio]ethylamino]-sulfanylidenemethyl]amino]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[2-(4-chlorophenyl)sulfanylethylcarbamothioylamino]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[2-[(4-chlorophenyl)thio]ethylthiocarbamoylamino]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C16H27ClN3S2+ MolecularWeight: 360.98868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=S)NCCSC1=CC=C(C=C1)Cl)C[NH+](C)C

Isomeric SMILES

CC(C)(CNC(=S)NCCSC1=CC=C(C=C1)Cl)C[NH+](C)C

InChI

InChI=1S/C16H26ClN3S2/c1-16(2,12-20(3)4)11-19-15(21)18-9-10-22-14-7-5-13(17)6-8-14/h5-8H,9-12H2,1-4H3,(H2,18,19,21)/p+1