methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-[[(2R)-oxan-2-yl]methyl]azanium

Systemtic Name: methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-[[(2R)-oxan-2-yl]methyl]azanium Openeye Name: methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]-[[(2R)-tetrahydropyran-2-yl]methyl]ammonium CAS Name: methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]-[[(2R)-2-oxanyl]methyl]ammonium IUPAC Name: methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]-[[(2R)-oxan-2-yl]methyl]azanium Traditional Name: [2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-[[(2R)-tetrahydropyran-2-yl]methyl]ammonium Formula: C16H25N2O2S+ MolecularWeight: 309.4469

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CCCCO1)CC(=O)NC2=CC=CC=C2SC

Isomeric SMILES

C[NH+](C[C@H]1CCCCO1)CC(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C16H24N2O2S/c1-18(11-13-7-5-6-10-20-13)12-16(19)17-14-8-3-4-9-15(14)21-2/h3-4,8-9,13H,5-7,10-12H2,1-2H3,(H,17,19)/p+1/t13-/m1/s1