3-(4-methoxyphenyl)-5-methylsulfanyl-1-methylsulfonyl-1,2,4-triazole

Systemtic Name: 3-(4-methoxyphenyl)-5-methylsulfanyl-1-methylsulfonyl-1,2,4-triazole Openeye Name: 3-(4-methoxyphenyl)-5-methylsulfanyl-1-methylsulfonyl-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-1-methylsulfonyl-5-(methylthio)-1,2,4-triazole IUPAC Name: 3-(4-methoxyphenyl)-5-methylsulfanyl-1-methylsulfonyl-1,2,4-triazole Traditional Name: 1-mesyl-3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazole Formula: C11H13N3O3S2 MolecularWeight: 299.36922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=N2)SC)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=N2)SC)S(=O)(=O)C

InChI

InChI=1S/C11H13N3O3S2/c1-17-9-6-4-8(5-7-9)10-12-11(18-2)14(13-10)19(3,15)16/h4-7H,1-3H3