1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-4-methyl-pentan-1-one

Systemtic Name: 1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-4-methyl-pentan-1-one Openeye Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-1-piperidyl]-4-methyl-pentan-1-one CAS Name: 1-[3-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinyl]-4-methyl-1-pentanone IUPAC Name: 1-[3-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-4-methylpentan-1-one Traditional Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidino]-4-methyl-pentan-1-one Formula: C23H29BrN6O MolecularWeight: 485.41996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29BrN6O/c1-16(2)7-8-22(31)29-10-4-6-18(15-29)20-11-21(26-13-17-5-3-9-25-12-17)30-23(28-20)19(24)14-27-30/h3,5,9,11-12,14,16,18,26H,4,6-8,10,13,15H2,1-2H3