N-(2-adamantyl)-1-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyrazole-4-carboxamide

Systemtic Name: N-(2-adamantyl)-1-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyrazole-4-carboxamide Openeye Name: N-(2-adamantyl)-1-(4-fluorophenyl)-5-(4-pyridylmethoxy)pyrazole-4-carboxamide CAS Name: N-(2-adamantyl)-1-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)-4-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-1-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyrazole-4-carboxamide Traditional Name: N-(2-adamantyl)-1-(4-fluorophenyl)-5-(4-pyridylmethoxy)pyrazole-4-carboxamide Formula: C26H27FN4O2 MolecularWeight: 446.516583

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=C(N(N=C4)C5=CC=C(C=C5)F)OCC6=CC=NC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=C(N(N=C4)C5=CC=C(C=C5)F)OCC6=CC=NC=C6

InChI

InChI=1S/C26H27FN4O2/c27-21-1-3-22(4-2-21)31-26(33-15-16-5-7-28-8-6-16)23(14-29-31)25(32)30-24-19-10-17-9-18(12-19)13-20(24)11-17/h1-8,14,17-20,24H,9-13,15H2,(H,30,32)