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

Systemtic Name: 2-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-diethyl-azanium Openeye Name: 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-diethyl-ammonium CAS Name: 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl-[methylamino(sulfanylidene)methyl]amino]ethyl-diethylammonium IUPAC Name: 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-diethylazanium Traditional Name: 2-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl-(methylthiocarbamoyl)amino]ethyl-diethyl-ammonium Formula: C20H31N4O2S+ MolecularWeight: 391.55074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(CC1=CC2=C(C=CC(=C2)OCC)NC1=O)C(=S)NC

Isomeric SMILES

CC[NH+](CC)CCN(CC1=CC2=C(C=CC(=C2)OCC)NC1=O)C(=S)NC

InChI

InChI=1S/C20H30N4O2S/c1-5-23(6-2)10-11-24(20(27)21-4)14-16-12-15-13-17(26-7-3)8-9-18(15)22-19(16)25/h8-9,12-13H,5-7,10-11,14H2,1-4H3,(H,21,27)(H,22,25)/p+1