dimethyl-[3-[(2-quinolin-8-ylsulfanylethanoylamino)carbamothioylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[(2-quinolin-8-ylsulfanylethanoylamino)carbamothioylamino]propyl]azanium Openeye Name: dimethyl-[3-[[[2-(8-quinolylsulfanyl)acetyl]amino]carbamothioylamino]propyl]ammonium CAS Name: dimethyl-[3-[[[[1-oxo-2-(8-quinolinylthio)ethyl]hydrazo]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[(2-quinolin-8-ylsulfanylacetyl)amino]carbamothioylamino]propyl]azanium Traditional Name: dimethyl-[3-[[[2-(8-quinolylthio)acetyl]amino]thiocarbamoylamino]propyl]ammonium Formula: C17H24N5OS2+ MolecularWeight: 378.53536

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NNC(=O)CSC1=CC=CC2=C1N=CC=C2

Isomeric SMILES

C[NH+](C)CCCNC(=S)NNC(=O)CSC1=CC=CC2=C1N=CC=C2

InChI

InChI=1S/C17H23N5OS2/c1-22(2)11-5-10-19-17(24)21-20-15(23)12-25-14-8-3-6-13-7-4-9-18-16(13)14/h3-4,6-9H,5,10-12H2,1-2H3,(H,20,23)(H2,19,21,24)/p+1