1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2-phenoxy-propan-1-one

Systemtic Name: 1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2-phenoxy-propan-1-one Openeye Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-1-piperidyl]-2-phenoxy-propan-1-one CAS Name: 1-[3-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinyl]-2-phenoxy-1-propanone IUPAC Name: 1-[3-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2-phenoxypropan-1-one Traditional Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidino]-2-phenoxy-propan-1-one Formula: C26H27BrN6O2 MolecularWeight: 535.43558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC(C1)C2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br)OC5=CC=CC=C5

Isomeric SMILES

CC(C(=O)N1CCCC(C1)C2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br)OC5=CC=CC=C5

InChI

InChI=1S/C26H27BrN6O2/c1-18(35-21-9-3-2-4-10-21)26(34)32-12-6-8-20(17-32)23-13-24(29-15-19-7-5-11-28-14-19)33-25(31-23)22(27)16-30-33/h2-5,7,9-11,13-14,16,18,20,29H,6,8,12,15,17H2,1H3