5-methylsulfanyl-1-(4-methylsulfonylphenyl)-3-phenyl-1,2,4-triazole

Systemtic Name: 5-methylsulfanyl-1-(4-methylsulfonylphenyl)-3-phenyl-1,2,4-triazole Openeye Name: 5-methylsulfanyl-1-(4-methylsulfonylphenyl)-3-phenyl-1,2,4-triazole CAS Name: 1-(4-methylsulfonylphenyl)-5-(methylthio)-3-phenyl-1,2,4-triazole IUPAC Name: 5-methylsulfanyl-1-(4-methylsulfonylphenyl)-3-phenyl-1,2,4-triazole Traditional Name: 1-(4-mesylphenyl)-5-(methylthio)-3-phenyl-1,2,4-triazole Formula: C16H15N3O2S2 MolecularWeight: 345.4392

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NN1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=NN1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O2S2/c1-22-16-17-15(12-6-4-3-5-7-12)18-19(16)13-8-10-14(11-9-13)23(2,20)21/h3-11H,1-2H3