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

Systemtic Name: 2-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine Openeye Name: 2-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine CAS Name: 2-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine IUPAC Name: 2-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine Traditional Name: 5-mesyl-2-[5-p-phenetyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]pyridine Formula: C17H15F3N4O3S MolecularWeight: 412.38621

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=NN2C3=NC=C(C=C3)S(=O)(=O)C)C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=NN2C3=NC=C(C=C3)S(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C17H15F3N4O3S/c1-3-27-12-6-4-11(5-7-12)15-22-16(17(18,19)20)23-24(15)14-9-8-13(10-21-14)28(2,25)26/h4-10H,3H2,1-2H3