(2-chloranylquinolin-3-yl)methyl-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2-chloranylquinolin-3-yl)methyl-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (2-chloro-3-quinolyl)methyl-methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]ammonium CAS Name: (2-chloro-3-quinolinyl)methyl-methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]ammonium IUPAC Name: (2-chloroquinolin-3-yl)methyl-methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]azanium Traditional Name: (2-chloro-3-quinolyl)methyl-[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-ammonium Formula: C20H21ClN3OS+ MolecularWeight: 386.91824

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=CC=CC=C2N=C1Cl)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

C[NH+](CC1=CC2=CC=CC=C2N=C1Cl)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C20H20ClN3OS/c1-24(13-19(25)22-17-9-5-6-10-18(17)26-2)12-15-11-14-7-3-4-8-16(14)23-20(15)21/h3-11H,12-13H2,1-2H3,(H,22,25)/p+1