N-(1-adamantyl)-3-bromanyl-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: N-(1-adamantyl)-3-bromanyl-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-(1-adamantyl)-3-bromo-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-(1-adamantyl)-3-bromo-5-phenyl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(1-adamantyl)-3-bromo-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-(1-adamantyl)-3-bromo-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C24H22BrF3N4O MolecularWeight: 519.35689

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=NN5C(=CC(=NC5=C4Br)C6=CC=CC=C6)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=NN5C(=CC(=NC5=C4Br)C6=CC=CC=C6)C(F)(F)F

InChI

InChI=1S/C24H22BrF3N4O/c25-19-20(22(33)30-23-10-13-6-14(11-23)8-15(7-13)12-23)31-32-18(24(26,27)28)9-17(29-21(19)32)16-4-2-1-3-5-16/h1-5,9,13-15H,6-8,10-12H2,(H,30,33)