1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2-cyclopentyl-2-phenyl-ethanone

Systemtic Name: 1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2-cyclopentyl-2-phenyl-ethanone Openeye Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-1-piperidyl]-2-cyclopentyl-2-phenyl-ethanone CAS Name: 1-[3-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinyl]-2-cyclopentyl-2-phenylethanone IUPAC Name: 1-[3-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2-cyclopentyl-2-phenylethanone Traditional Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidino]-2-cyclopentyl-2-phenyl-ethanone Formula: C30H33BrN6O MolecularWeight: 573.52662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)C(=O)N3CCCC(C3)C4=NC5=C(C=NN5C(=C4)NCC6=CN=CC=C6)Br

Isomeric SMILES

C1CCC(C1)C(C2=CC=CC=C2)C(=O)N3CCCC(C3)C4=NC5=C(C=NN5C(=C4)NCC6=CN=CC=C6)Br

InChI

InChI=1S/C30H33BrN6O/c31-25-19-34-37-27(33-18-21-8-6-14-32-17-21)16-26(35-29(25)37)24-13-7-15-36(20-24)30(38)28(23-11-4-5-12-23)22-9-2-1-3-10-22/h1-3,6,8-10,14,16-17,19,23-24,28,33H,4-5,7,11-13,15,18,20H2