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

Systemtic Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxidanylidene-2-[(3-phenoxyphenyl)amino]ethyl]azanium Openeye Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxo-2-(3-phenoxyanilino)ethyl]ammonium CAS Name: methyl-[[4-(methylthio)phenyl]methyl]-[2-oxo-2-(3-phenoxyanilino)ethyl]ammonium IUPAC Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxo-2-(3-phenoxyanilino)ethyl]azanium Traditional Name: [2-keto-2-(3-phenoxyanilino)ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C23H25N2O2S+ MolecularWeight: 393.5218

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O2S/c1-25(16-18-11-13-22(28-2)14-12-18)17-23(26)24-19-7-6-10-21(15-19)27-20-8-4-3-5-9-20/h3-15H,16-17H2,1-2H3,(H,24,26)/p+1