2-[butylcarbamothioyl-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-diethyl-azanium

Systemtic Name: 2-[butylcarbamothioyl-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-diethyl-azanium Openeye Name: 2-[butylcarbamothioyl-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[butylamino(sulfanylidene)methyl]-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-diethylammonium IUPAC Name: 2-[butylcarbamothioyl-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-diethylazanium Traditional Name: 2-[butylthiocarbamoyl-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]amino]ethyl-diethyl-ammonium Formula: C23H37N4OS+ MolecularWeight: 417.63108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N4OS/c1-6-9-10-24-23(29)27(12-11-26(7-2)8-3)16-19-15-20-18(5)13-17(4)14-21(20)25-22(19)28/h13-15H,6-12,16H2,1-5H3,(H,24,29)(H,25,28)/p+1