methyl-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: methyl-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-(o-tolylmethylamino)-2-oxo-ethyl]ammonium CAS Name: methyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: methyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [2-keto-2-[(2-methylbenzyl)amino]ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C19H25N2OS+ MolecularWeight: 329.4796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C[NH+](C)CC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C[NH+](C)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C19H24N2OS/c1-15-6-4-5-7-17(15)12-20-19(22)14-21(2)13-16-8-10-18(23-3)11-9-16/h4-11H,12-14H2,1-3H3,(H,20,22)/p+1