N-methyl-N-(pyrimidin-4-ylmethyl)-5-[[3-(trifluoromethyl)phenoxy]methyl]-1H-pyrazole-3-carboxamide

Systemtic Name: N-methyl-N-(pyrimidin-4-ylmethyl)-5-[[3-(trifluoromethyl)phenoxy]methyl]-1H-pyrazole-3-carboxamide Openeye Name: N-methyl-N-(pyrimidin-4-ylmethyl)-5-[[3-(trifluoromethyl)phenoxy]methyl]-1H-pyrazole-3-carboxamide CAS Name: N-methyl-N-(4-pyrimidinylmethyl)-5-[[3-(trifluoromethyl)phenoxy]methyl]-1H-pyrazole-3-carboxamide IUPAC Name: N-methyl-N-(pyrimidin-4-ylmethyl)-5-[[3-(trifluoromethyl)phenoxy]methyl]-1H-pyrazole-3-carboxamide Traditional Name: N-methyl-N-(4-pyrimidylmethyl)-5-[[3-(trifluoromethyl)phenoxy]methyl]-1H-pyrazole-3-carboxamide Formula: C18H16F3N5O2 MolecularWeight: 391.34715

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC=NC=C1)C(=O)C2=NNC(=C2)COC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CN(CC1=NC=NC=C1)C(=O)C2=NNC(=C2)COC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H16F3N5O2/c1-26(9-13-5-6-22-11-23-13)17(27)16-8-14(24-25-16)10-28-15-4-2-3-12(7-15)18(19,20)21/h2-8,11H,9-10H2,1H3,(H,24,25)