3-[[(4,8-dimethylquinolin-2-yl)amino]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4,8-dimethylquinolin-2-yl)amino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(4,8-dimethyl-2-quinolyl)amino]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[(4,8-dimethyl-2-quinolinyl)hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(4,8-dimethylquinolin-2-yl)amino]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[(4,8-dimethyl-2-quinolyl)amino]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C17H26N5S+ MolecularWeight: 332.48684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)NNC(=S)NCCC[NH+](C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)NNC(=S)NCCC[NH+](C)C

InChI

InChI=1S/C17H25N5S/c1-12-7-5-8-14-13(2)11-15(19-16(12)14)20-21-17(23)18-9-6-10-22(3)4/h5,7-8,11H,6,9-10H2,1-4H3,(H,19,20)(H2,18,21,23)/p+1