4-methyl-3-(4-methylphenyl)-5-methylsulfonyl-1,2,4-triazole

Systemtic Name: 4-methyl-3-(4-methylphenyl)-5-methylsulfonyl-1,2,4-triazole Openeye Name: 4-methyl-3-methylsulfonyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 4-methyl-3-(4-methylphenyl)-5-methylsulfonyl-1,2,4-triazole IUPAC Name: 4-methyl-3-(4-methylphenyl)-5-methylsulfonyl-1,2,4-triazole Traditional Name: 3-mesyl-4-methyl-5-(p-tolyl)-1,2,4-triazole Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)S(=O)(=O)C

InChI

InChI=1S/C11H13N3O2S/c1-8-4-6-9(7-5-8)10-12-13-11(14(10)2)17(3,15)16/h4-7H,1-3H3