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

Systemtic Name: diethyl-[3-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(2-methylpropylcarbamothioyl)amino]propyl]azanium Openeye Name: diethyl-[3-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(isobutylcarbamothioyl)amino]propyl]ammonium CAS Name: diethyl-[3-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-[(2-methylpropylamino)-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(2-methylpropylcarbamothioyl)amino]propyl]azanium Traditional Name: diethyl-[3-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl-(isobutylthiocarbamoyl)amino]propyl]ammonium Formula: C24H39N4OS+ MolecularWeight: 431.65766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H38N4OS/c1-6-19-10-11-22-20(14-19)15-21(23(29)26-22)17-28(24(30)25-16-18(4)5)13-9-12-27(7-2)8-3/h10-11,14-15,18H,6-9,12-13,16-17H2,1-5H3,(H,25,30)(H,26,29)/p+1