3-[[[2,5-bis(chloranyl)phenyl]carbonylamino]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[[2,5-bis(chloranyl)phenyl]carbonylamino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(2,5-dichlorobenzoyl)amino]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[(2,5-dichlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(2,5-dichlorobenzoyl)amino]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[(2,5-dichlorobenzoyl)amino]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C13H19Cl2N4OS+ MolecularWeight: 350.28716

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NNC(=O)C1=C(C=CC(=C1)Cl)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=S)NNC(=O)C1=C(C=CC(=C1)Cl)Cl

InChI

InChI=1S/C13H18Cl2N4OS/c1-19(2)7-3-6-16-13(21)18-17-12(20)10-8-9(14)4-5-11(10)15/h4-5,8H,3,6-7H2,1-2H3,(H,17,20)(H2,16,18,21)/p+1