3-[[2,6-bis(chloranyl)phenyl]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(2,6-dichlorophenyl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[(2,6-dichloroanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(2,6-dichlorophenyl)carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(2,6-dichlorophenyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C12H18Cl2N3S+ MolecularWeight: 307.26242

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NC1=C(C=CC=C1Cl)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=S)NC1=C(C=CC=C1Cl)Cl

InChI

InChI=1S/C12H17Cl2N3S/c1-17(2)8-4-7-15-12(18)16-11-9(13)5-3-6-10(11)14/h3,5-6H,4,7-8H2,1-2H3,(H2,15,16,18)/p+1