5-methyl-N-(3-phenylmethoxypropyl)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-N-(3-phenylmethoxypropyl)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide Openeye Name: N-(3-benzyloxypropyl)-5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxamide CAS Name: 5-methyl-N-(3-phenylmethoxypropyl)-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxamide IUPAC Name: 5-methyl-N-(3-phenylmethoxypropyl)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide Traditional Name: N-(3-benzoxypropyl)-5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxamide Formula: C21H21F3N4O2 MolecularWeight: 418.41225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C21H21F3N4O2/c1-15-18(13-27-28(15)19-9-8-17(12-26-19)21(22,23)24)20(29)25-10-5-11-30-14-16-6-3-2-4-7-16/h2-4,6-9,12-13H,5,10-11,14H2,1H3,(H,25,29)