5-methyl-3-(phenylsulfonylmethyl)-1H-1,2,4-triazole

Systemtic Name: 5-methyl-3-(phenylsulfonylmethyl)-1H-1,2,4-triazole Openeye Name: 3-(benzenesulfonylmethyl)-5-methyl-1H-1,2,4-triazole CAS Name: 3-(benzenesulfonylmethyl)-5-methyl-1H-1,2,4-triazole IUPAC Name: 3-(benzenesulfonylmethyl)-5-methyl-1H-1,2,4-triazole Traditional Name: 3-(besylmethyl)-5-methyl-1H-1,2,4-triazole Formula: C10H11N3O2S MolecularWeight: 237.27824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=NC(=NN1)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C10H11N3O2S/c1-8-11-10(13-12-8)7-16(14,15)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,12,13)