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

Systemtic Name: 3-(4-methoxyphenyl)-5-methylsulfanyl-1-(phenylsulfonyl)-1,2,4-triazole Openeye Name: 1-(benzenesulfonyl)-3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazole CAS Name: 1-(benzenesulfonyl)-3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazole IUPAC Name: 1-(benzenesulfonyl)-3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazole Traditional Name: 1-besyl-3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazole Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=N2)SC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=N2)SC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O3S2/c1-22-13-10-8-12(9-11-13)15-17-16(23-2)19(18-15)24(20,21)14-6-4-3-5-7-14/h3-11H,1-2H3