[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [2-(3,5-dimethylanilino)-2-oxoethyl]-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [2-(3,5-dimethylanilino)-2-keto-ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C19H25N2OS+ MolecularWeight: 329.4796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2OS/c1-14-9-15(2)11-17(10-14)20-19(22)13-21(3)12-16-5-7-18(23-4)8-6-16/h5-11H,12-13H2,1-4H3,(H,20,22)/p+1