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

Systemtic Name: N-[1-(1-adamantyl)propyl]-7-(4-bromanyl-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-[1-(1-adamantyl)propyl]-7-(4-bromo-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-[1-(1-adamantyl)propyl]-7-(4-bromo-1-ethyl-3-pyrazolyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-[1-(1-adamantyl)propyl]-7-(4-bromo-1-ethylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-[1-(1-adamantyl)propyl]-7-(4-bromo-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C25H31BrN6O MolecularWeight: 511.45724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=NN5C(=CC=NC5=C4)C6=NN(C=C6Br)CC

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=NN5C(=CC=NC5=C4)C6=NN(C=C6Br)CC

InChI

InChI=1S/C25H31BrN6O/c1-3-21(25-11-15-7-16(12-25)9-17(8-15)13-25)28-24(33)19-10-22-27-6-5-20(32(22)29-19)23-18(26)14-31(4-2)30-23/h5-6,10,14-17,21H,3-4,7-9,11-13H2,1-2H3,(H,28,33)