1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-1-piperidyl]-3-phenyl-propan-1-one CAS Name: 1-[3-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinyl]-3-phenyl-1-propanone IUPAC Name: 1-[3-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidino]-3-phenyl-propan-1-one Formula: C26H27BrN6O MolecularWeight: 519.43618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2=CC=CC=C2)C3=NC4=C(C=NN4C(=C3)NCC5=CN=CC=C5)Br

Isomeric SMILES

C1CC(CN(C1)C(=O)CCC2=CC=CC=C2)C3=NC4=C(C=NN4C(=C3)NCC5=CN=CC=C5)Br

InChI

InChI=1S/C26H27BrN6O/c27-22-17-30-33-24(29-16-20-8-4-12-28-15-20)14-23(31-26(22)33)21-9-5-13-32(18-21)25(34)11-10-19-6-2-1-3-7-19/h1-4,6-8,12,14-15,17,21,29H,5,9-11,13,16,18H2