[4-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-cyclopropyl-methanone

Systemtic Name: [4-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-cyclopropyl-methanone Openeye Name: [4-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-1-piperidyl]-cyclopropyl-methanone CAS Name: [4-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinyl]-cyclopropylmethanone IUPAC Name: [4-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-cyclopropylmethanone Traditional Name: [4-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidino]-cyclopropyl-methanone Formula: C21H23BrN6O MolecularWeight: 455.35092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC(CC2)C3=NC4=C(C=NN4C(=C3)NCC5=CN=CC=C5)Br

Isomeric SMILES

C1CC1C(=O)N2CCC(CC2)C3=NC4=C(C=NN4C(=C3)NCC5=CN=CC=C5)Br

InChI

InChI=1S/C21H23BrN6O/c22-17-13-25-28-19(24-12-14-2-1-7-23-11-14)10-18(26-20(17)28)15-5-8-27(9-6-15)21(29)16-3-4-16/h1-2,7,10-11,13,15-16,24H,3-6,8-9,12H2