5-tert-butyl-3-(methylsulfonylmethylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-tert-butyl-3-(methylsulfonylmethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-tert-butyl-3-(methylsulfonylmethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-tert-butyl-3-(methylsulfonylmethylthio)-1H-1,2,4-triazole IUPAC Name: 5-tert-butyl-3-(methylsulfonylmethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-tert-butyl-3-(mesylmethylthio)-1H-1,2,4-triazole Formula: C8H15N3O2S2 MolecularWeight: 249.3536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NN1)SCS(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=NC(=NN1)SCS(=O)(=O)C

InChI

InChI=1S/C8H15N3O2S2/c1-8(2,3)6-9-7(11-10-6)14-5-15(4,12)13/h5H2,1-4H3,(H,9,10,11)