N-(2-adamantyl)-7-(4-bromanyl-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: N-(2-adamantyl)-7-(4-bromanyl-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-(2-adamantyl)-7-(4-bromo-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-(2-adamantyl)-7-(4-bromo-1-ethyl-3-pyrazolyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(2-adamantyl)-7-(4-bromo-1-ethylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-(2-adamantyl)-7-(4-bromo-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C22H25BrN6O MolecularWeight: 469.3775

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C2=CC=NC3=CC(=NN23)C(=O)NC4C5CC6CC(C5)CC4C6)Br

Isomeric SMILES

CCN1C=C(C(=N1)C2=CC=NC3=CC(=NN23)C(=O)NC4C5CC6CC(C5)CC4C6)Br

InChI

InChI=1S/C22H25BrN6O/c1-2-28-11-16(23)21(27-28)18-3-4-24-19-10-17(26-29(18)19)22(30)25-20-14-6-12-5-13(8-14)9-15(20)7-12/h3-4,10-15,20H,2,5-9H2,1H3,(H,25,30)