N-(1-adamantyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-(1-adamantyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(1-adamantyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(1-adamantyl)-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(1-adamantyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H22F3N3O MolecularWeight: 389.41409

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F

InChI

InChI=1S/C21H22F3N3O/c22-21(23,24)18-17(12-25-27(18)16-4-2-1-3-5-16)19(28)26-20-9-13-6-14(10-20)8-15(7-13)11-20/h1-5,12-15H,6-11H2,(H,26,28)