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

Systemtic Name: 3-[butylcarbamothioyl-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]propyl-diethyl-azanium Openeye Name: 3-[butylcarbamothioyl-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[butylamino(sulfanylidene)methyl]-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-diethylammonium IUPAC Name: 3-[butylcarbamothioyl-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-diethylazanium Traditional Name: 3-[butylthiocarbamoyl-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]amino]propyl-diethyl-ammonium Formula: C24H39N4OS+ MolecularWeight: 431.65766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H38N4OS/c1-6-9-11-25-24(30)28(13-10-12-27(7-2)8-3)17-20-16-21-19(5)14-18(4)15-22(21)26-23(20)29/h14-16H,6-13,17H2,1-5H3,(H,25,30)(H,26,29)/p+1