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

Systemtic Name: dimethyl-[2-[(2-quinolin-8-ylsulfanylethanoylamino)carbamothioylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[[2-(8-quinolylsulfanyl)acetyl]amino]carbamothioylamino]ethyl]ammonium CAS Name: dimethyl-[2-[[[[1-oxo-2-(8-quinolinylthio)ethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[(2-quinolin-8-ylsulfanylacetyl)amino]carbamothioylamino]ethyl]azanium Traditional Name: dimethyl-[2-[[[2-(8-quinolylthio)acetyl]amino]thiocarbamoylamino]ethyl]ammonium Formula: C16H22N5OS2+ MolecularWeight: 364.50878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5OS2/c1-21(2)10-9-18-16(23)20-19-14(22)11-24-13-7-3-5-12-6-4-8-17-15(12)13/h3-8H,9-11H2,1-2H3,(H,19,22)(H2,18,20,23)/p+1