2-[butylcarbamothioyl-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-diethyl-azanium

Systemtic Name: 2-[butylcarbamothioyl-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-diethyl-azanium Openeye Name: 2-[butylcarbamothioyl-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[butylamino(sulfanylidene)methyl]-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-diethylammonium IUPAC Name: 2-[butylcarbamothioyl-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-diethylazanium Traditional Name: 2-[butylthiocarbamoyl-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]amino]ethyl-diethyl-ammonium Formula: C23H37N4OS+ MolecularWeight: 417.63108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CC[NH+](CC)CC)CC1=CC2=C(C=CC(=C2NC1=O)C)C

Isomeric SMILES

CCCCNC(=S)N(CC[NH+](CC)CC)CC1=CC2=C(C=CC(=C2NC1=O)C)C

InChI

InChI=1S/C23H36N4OS/c1-6-9-12-24-23(29)27(14-13-26(7-2)8-3)16-19-15-20-17(4)10-11-18(5)21(20)25-22(19)28/h10-11,15H,6-9,12-14,16H2,1-5H3,(H,24,29)(H,25,28)/p+1