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

Systemtic Name: dimethyl-[2-[methylcarbamothioyl-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl]azanium Openeye Name: dimethyl-[2-[methylcarbamothioyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[methylamino(sulfanylidene)methyl]-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[methylcarbamothioyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl]azanium Traditional Name: 2-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl-(methylthiocarbamoyl)amino]ethyl-dimethyl-ammonium Formula: C17H25N4OS+ MolecularWeight: 333.4716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC[NH+](C)C)C(=S)NC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC[NH+](C)C)C(=S)NC

InChI

InChI=1S/C17H24N4OS/c1-12-5-6-15-13(9-12)10-14(16(22)19-15)11-21(17(23)18-2)8-7-20(3)4/h5-6,9-10H,7-8,11H2,1-4H3,(H,18,23)(H,19,22)/p+1