3-methyl-2-methylsulfanyl-2H-1,3-benzoxazole; methyl sulfate

Systemtic Name: 3-methyl-2-methylsulfanyl-2H-1,3-benzoxazole; methyl sulfate Openeye Name: 3-methyl-2-methylsulfanyl-2H-1,3-benzoxazole; methyl sulfate CAS Name: 3-methyl-2-(methylthio)-2H-1,3-benzoxazole; methyl sulfate IUPAC Name: 3-methyl-2-methylsulfanyl-2H-1,3-benzoxazole; methyl sulfate Traditional Name: 3-methyl-2-(methylthio)-2H-1,3-benzoxazole; methyl sulfate Formula: C10H14NO5S2- MolecularWeight: 292.35186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(OC2=CC=CC=C21)SC.COS(=O)(=O)[O-]

Isomeric SMILES

CN1C(OC2=CC=CC=C21)SC.COS(=O)(=O)[O-]

InChI

InChI=1S/C9H11NOS.CH4O4S/c1-10-7-5-3-4-6-8(7)11-9(10)12-2;1-5-6(2,3)4/h3-6,9H,1-2H3;1H3,(H,2,3,4)/p-1