diethyl-[3-[[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)carbamothioyl]amino]propyl]azanium

Systemtic Name: diethyl-[3-[[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)carbamothioyl]amino]propyl]azanium Openeye Name: diethyl-[3-[[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)carbamothioyl]amino]propyl]ammonium CAS Name: diethyl-[3-[[[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)amino]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)carbamothioyl]amino]propyl]azanium Traditional Name: diethyl-[3-[[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)thiocarbamoyl]amino]propyl]ammonium Formula: C23H37N4O2S+ MolecularWeight: 433.63048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)C(=S)NCCC[NH+](CC)CC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)C(=S)NCCC[NH+](CC)CC

InChI

InChI=1S/C23H36N4O2S/c1-4-18-9-10-21-19(15-18)16-20(22(29)25-21)17-27(13-8-14-28)23(30)24-11-7-12-26(5-2)6-3/h9-10,15-16,28H,4-8,11-14,17H2,1-3H3,(H,24,30)(H,25,29)/p+1