5-methylsulfanyl-1-(phenylsulfonylmethyl)-1,2,4-triazole

Systemtic Name: 5-methylsulfanyl-1-(phenylsulfonylmethyl)-1,2,4-triazole Openeye Name: 1-(benzenesulfonylmethyl)-5-methylsulfanyl-1,2,4-triazole CAS Name: 1-(benzenesulfonylmethyl)-5-(methylthio)-1,2,4-triazole IUPAC Name: 1-(benzenesulfonylmethyl)-5-methylsulfanyl-1,2,4-triazole Traditional Name: 1-(besylmethyl)-5-(methylthio)-1,2,4-triazole Formula: C10H11N3O2S2 MolecularWeight: 269.34324

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=NN1CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CSC1=NC=NN1CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C10H11N3O2S2/c1-16-10-11-7-12-13(10)8-17(14,15)9-5-3-2-4-6-9/h2-7H,8H2,1H3