3-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-[methylamino(sulfanylidene)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]propyl-dimethylazanium Traditional Name: 3-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl-(methylthiocarbamoyl)amino]propyl-dimethyl-ammonium Formula: C19H29N4OS+ MolecularWeight: 361.52476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC[NH+](C)C)C(=S)NC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC[NH+](C)C)C(=S)NC

InChI

InChI=1S/C19H28N4OS/c1-5-14-7-8-17-15(11-14)12-16(18(24)21-17)13-23(19(25)20-2)10-6-9-22(3)4/h7-8,11-12H,5-6,9-10,13H2,1-4H3,(H,20,25)(H,21,24)/p+1