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

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-methylsulfanylphenyl)methyl]-propyl-azanium Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl]-[(4-methylsulfanylphenyl)methyl]-propyl-ammonium CAS Name: [2-(2-methylanilino)-2-oxoethyl]-[[4-(methylthio)phenyl]methyl]-propylammonium IUPAC Name: [2-(2-methylanilino)-2-oxoethyl]-[(4-methylsulfanylphenyl)methyl]-propylazanium Traditional Name: [2-keto-2-(o-toluidino)ethyl]-[4-(methylthio)benzyl]-propyl-ammonium Formula: C20H27N2OS+ MolecularWeight: 343.50618

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCC[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C20H26N2OS/c1-4-13-22(14-17-9-11-18(24-3)12-10-17)15-20(23)21-19-8-6-5-7-16(19)2/h5-12H,4,13-15H2,1-3H3,(H,21,23)/p+1