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

Systemtic Name: 2-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-5-methylsulfonyl-pyridine Openeye Name: 2-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-5-methylsulfonyl-pyridine CAS Name: 2-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1-pyrazolyl]-5-methylsulfonylpyridine IUPAC Name: 2-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-5-methylsulfonylpyridine Traditional Name: 5-mesyl-2-[5-p-phenetyl-3-(trifluoromethyl)pyrazol-1-yl]pyridine Formula: C18H16F3N3O3S MolecularWeight: 411.39815

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16F3N3O3S/c1-3-27-13-6-4-12(5-7-13)15-10-16(18(19,20)21)23-24(15)17-9-8-14(11-22-17)28(2,25)26/h4-11H,3H2,1-2H3