3-[[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(2-morpholin-4-ium-4-ylethyl)carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(2-morpholin-4-ium-4-ylethyl)carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-(2-morpholin-4-ium-4-ylethyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[2-(4-morpholin-4-iumyl)ethyl]amino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-(2-morpholin-4-ium-4-ylethyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl-(2-morpholin-4-ium-4-ylethyl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C24H39N5O4S+2 MolecularWeight: 493.66256

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N(CC[NH+]1CCOCC1)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

Isomeric SMILES

C[NH+](C)CCCNC(=S)N(CC[NH+]1CCOCC1)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

InChI

InChI=1S/C24H37N5O4S/c1-27(2)7-5-6-25-24(34)29(9-8-28-10-12-33-13-11-28)17-19-14-18-15-21(31-3)22(32-4)16-20(18)26-23(19)30/h14-16H,5-13,17H2,1-4H3,(H,25,34)(H,26,30)/p+2