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

Systemtic Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-(3-methylsulfonylanilino)-2-oxo-ethyl]ammonium CAS Name: methyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-(3-methylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(3-mesylanilino)ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C18H23N2O3S2+ MolecularWeight: 379.51682

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C18H22N2O3S2/c1-20(12-14-7-9-16(24-2)10-8-14)13-18(21)19-15-5-4-6-17(11-15)25(3,22)23/h4-11H,12-13H2,1-3H3,(H,19,21)/p+1