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

Systemtic Name: N-(1-adamantyl)-5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide Openeye Name: N-(1-adamantyl)-5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxamide CAS Name: N-(1-adamantyl)-5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide Traditional Name: N-(1-adamantyl)-5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxamide Formula: C21H23F3N4O MolecularWeight: 404.42873

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H23F3N4O/c1-12-17(11-26-28(12)18-3-2-16(10-25-18)21(22,23)24)19(29)27-20-7-13-4-14(8-20)6-15(5-13)9-20/h2-3,10-11,13-15H,4-9H2,1H3,(H,27,29)