trimethyl-[(2S)-3-(2-methylsulfanyl-1H-imidazol-5-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: trimethyl-[(2S)-3-(2-methylsulfanyl-1H-imidazol-5-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-hydroxy-1-[(2-methylsulfanyl-1H-imidazol-5-yl)methyl]-2-oxo-ethyl]-trimethyl-ammonium CAS Name: [(2S)-1-hydroxy-3-[2-(methylthio)-1H-imidazol-5-yl]-1-oxopropan-2-yl]-trimethylammonium IUPAC Name: [(2S)-1-hydroxy-3-(2-methylsulfanyl-1H-imidazol-5-yl)-1-oxopropan-2-yl]-trimethylazanium Traditional Name: [(1S)-2-hydroxy-2-keto-1-[[2-(methylthio)-1H-imidazol-5-yl]methyl]ethyl]-trimethyl-ammonium Formula: C10H18N3O2S+ MolecularWeight: 244.33382

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CC1=CN=C(N1)SC)C(=O)O

Isomeric SMILES

C[N+](C)(C)[C@@H](CC1=CN=C(N1)SC)C(=O)O

InChI

InChI=1S/C10H17N3O2S/c1-13(2,3)8(9(14)15)5-7-6-11-10(12-7)16-4/h6,8H,5H2,1-4H3,(H-,11,12,14,15)/p+1/t8-/m0/s1