methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: methyl-[4-(methylcarbamoyl)benzyl]-[4-(methylthio)benzyl]ammonium Formula: C18H23N2OS+ MolecularWeight: 315.45302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2OS/c1-19-18(21)16-8-4-14(5-9-16)12-20(2)13-15-6-10-17(22-3)11-7-15/h4-11H,12-13H2,1-3H3,(H,19,21)/p+1