3-(benzamidocarbamothioylamino)propyl-dimethyl-azanium

Systemtic Name: 3-(benzamidocarbamothioylamino)propyl-dimethyl-azanium Openeye Name: 3-(benzamidocarbamothioylamino)propyl-dimethyl-ammonium CAS Name: 3-[[(benzoylhydrazo)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-(benzamidocarbamothioylamino)propyl-dimethylazanium Traditional Name: 3-(benzamidothiocarbamoylamino)propyl-dimethyl-ammonium Formula: C13H21N4OS+ MolecularWeight: 281.39704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N4OS/c1-17(2)10-6-9-14-13(19)16-15-12(18)11-7-4-3-5-8-11/h3-5,7-8H,6,9-10H2,1-2H3,(H,15,18)(H2,14,16,19)/p+1