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

Systemtic Name: N-(1-adamantyl)-1-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyrazole-4-carboxamide Openeye Name: N-(1-adamantyl)-1-(4-fluorophenyl)-5-(4-pyridylmethoxy)pyrazole-4-carboxamide CAS Name: N-(1-adamantyl)-1-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-1-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyrazole-4-carboxamide Traditional Name: N-(1-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)(C3)NC(=O)C4=C(N(N=C4)C5=CC=C(C=C5)F)OCC6=CC=NC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=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)31-25(33-16-17-5-7-28-8-6-17)23(15-29-31)24(32)30-26-12-18-9-19(13-26)11-20(10-18)14-26/h1-8,15,18-20H,9-14,16H2,(H,30,32)