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

Systemtic Name: N-(2-adamantyl)-3-bromanyl-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-(2-adamantyl)-3-bromo-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-(2-adamantyl)-3-bromo-5-methyl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(2-adamantyl)-3-bromo-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-(2-adamantyl)-3-bromo-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C19H20BrF3N4O MolecularWeight: 457.28751

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)C(F)(F)F)C(=O)NC3C4CC5CC(C4)CC3C5)Br

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)C(F)(F)F)C(=O)NC3C4CC5CC(C4)CC3C5)Br

InChI

InChI=1S/C19H20BrF3N4O/c1-8-2-13(19(21,22)23)27-17(24-8)14(20)16(26-27)18(28)25-15-11-4-9-3-10(6-11)7-12(15)5-9/h2,9-12,15H,3-7H2,1H3,(H,25,28)