2-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl-[methylamino(sulfanylidene)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl-(methylcarbamothioyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl-(methylthiocarbamoyl)amino]ethyl-dimethyl-ammonium Formula: C17H25N4O2S+ MolecularWeight: 349.471

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N(CC[NH+](C)C)CC1=CC2=C(C=CC(=C2)OC)NC1=O

Isomeric SMILES

CNC(=S)N(CC[NH+](C)C)CC1=CC2=C(C=CC(=C2)OC)NC1=O

InChI

InChI=1S/C17H24N4O2S/c1-18-17(24)21(8-7-20(2)3)11-13-9-12-10-14(23-4)5-6-15(12)19-16(13)22/h5-6,9-10H,7-8,11H2,1-4H3,(H,18,24)(H,19,22)/p+1