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

Systemtic Name: 1-(4-methylsulfonylphenyl)-5-phenyl-3-(trifluoromethyl)-1,2,4-triazole Openeye Name: 1-(4-methylsulfonylphenyl)-5-phenyl-3-(trifluoromethyl)-1,2,4-triazole CAS Name: 1-(4-methylsulfonylphenyl)-5-phenyl-3-(trifluoromethyl)-1,2,4-triazole IUPAC Name: 1-(4-methylsulfonylphenyl)-5-phenyl-3-(trifluoromethyl)-1,2,4-triazole Traditional Name: 1-(4-mesylphenyl)-5-phenyl-3-(trifluoromethyl)-1,2,4-triazole Formula: C16H12F3N3O2S MolecularWeight: 367.34559

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C16H12F3N3O2S/c1-25(23,24)13-9-7-12(8-10-13)22-14(11-5-3-2-4-6-11)20-15(21-22)16(17,18)19/h2-10H,1H3