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

Systemtic Name: 2-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[methylamino(sulfanylidene)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl-(methylthiocarbamoyl)amino]ethyl-dimethyl-ammonium Formula: C18H27N4OS+ MolecularWeight: 347.49818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CC[NH+](C)C)C(=S)NC

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CC[NH+](C)C)C(=S)NC

InChI

InChI=1S/C18H26N4OS/c1-12-6-7-13(2)16-15(12)10-14(17(23)20-16)11-22(18(24)19-3)9-8-21(4)5/h6-7,10H,8-9,11H2,1-5H3,(H,19,24)(H,20,23)/p+1