methyl-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: methyl-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: methyl-[2-(3-methylanilino)-2-oxo-ethyl]-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: methyl-[2-(3-methylanilino)-2-oxoethyl]-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: methyl-[2-(3-methylanilino)-2-oxoethyl]-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [2-keto-2-(m-toluidino)ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C18H23N2OS+ MolecularWeight: 315.45302

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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

Isomeric SMILES

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

InChI

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