2-[5-(4-bromophenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine

Systemtic Name: 2-[5-(4-bromophenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine Openeye Name: 2-[5-(4-bromophenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine CAS Name: 2-[5-(4-bromophenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine IUPAC Name: 2-[5-(4-bromophenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine Traditional Name: 2-[5-(4-bromophenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-mesyl-pyridine Formula: C15H10BrF3N4O2S MolecularWeight: 447.22971

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10BrF3N4O2S/c1-26(24,25)11-6-7-12(20-8-11)23-13(9-2-4-10(16)5-3-9)21-14(22-23)15(17,18)19/h2-8H,1H3