methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-phenethyl-azanium

Systemtic Name: methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-phenethyl-azanium Openeye Name: methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]-phenethyl-ammonium CAS Name: methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]-phenethylammonium IUPAC Name: methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]-phenethylazanium Traditional Name: [2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-phenethyl-ammonium Formula: C18H23N2OS+ MolecularWeight: 315.45302

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2SC

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C18H22N2OS/c1-20(13-12-15-8-4-3-5-9-15)14-18(21)19-16-10-6-7-11-17(16)22-2/h3-11H,12-14H2,1-2H3,(H,19,21)/p+1