(5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]azanium Openeye Name: [2-(2-allylsulfanylanilino)-2-oxo-ethyl]-[(5-chloro-2-methoxy-phenyl)methyl]-methyl-ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl]ammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl]azanium Traditional Name: [2-[2-(allylthio)anilino]-2-keto-ethyl]-(5-chloro-2-methoxy-benzyl)-methyl-ammonium Formula: C20H24ClN2O2S+ MolecularWeight: 391.93476

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC(=C1)Cl)OC)CC(=O)NC2=CC=CC=C2SCC=C

Isomeric SMILES

C[NH+](CC1=C(C=CC(=C1)Cl)OC)CC(=O)NC2=CC=CC=C2SCC=C

InChI

InChI=1S/C20H23ClN2O2S/c1-4-11-26-19-8-6-5-7-17(19)22-20(24)14-23(2)13-15-12-16(21)9-10-18(15)25-3/h4-10,12H,1,11,13-14H2,2-3H3,(H,22,24)/p+1