3-[(6,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]propyl-diethyl-azanium

Systemtic Name: 3-[(6,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]propyl-diethyl-azanium Openeye Name: 3-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]propyl-diethyl-ammonium CAS Name: 3-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[methylamino(sulfanylidene)methyl]amino]propyl-diethylammonium IUPAC Name: 3-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]propyl-diethylazanium Traditional Name: diethyl-[3-[(2-keto-6,8-dimethyl-1H-quinolin-3-yl)methyl-(methylthiocarbamoyl)amino]propyl]ammonium Formula: C21H33N4OS+ MolecularWeight: 389.57792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(CC1=CC2=CC(=CC(=C2NC1=O)C)C)C(=S)NC

Isomeric SMILES

CC[NH+](CC)CCCN(CC1=CC2=CC(=CC(=C2NC1=O)C)C)C(=S)NC

InChI

InChI=1S/C21H32N4OS/c1-6-24(7-2)9-8-10-25(21(27)22-5)14-18-13-17-12-15(3)11-16(4)19(17)23-20(18)26/h11-13H,6-10,14H2,1-5H3,(H,22,27)(H,23,26)/p+1