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

Systemtic Name: 1-[3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2-naphthalen-1-yl-ethanone Openeye Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-1-piperidyl]-2-(1-naphthyl)ethanone CAS Name: 1-[3-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinyl]-2-(1-naphthalenyl)ethanone IUPAC Name: 1-[3-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2-naphthalen-1-ylethanone Traditional Name: 1-[3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidino]-2-(1-naphthyl)ethanone Formula: C29H27BrN6O MolecularWeight: 555.46828

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CC2=CC=CC3=CC=CC=C32)C4=NC5=C(C=NN5C(=C4)NCC6=CN=CC=C6)Br

Isomeric SMILES

C1CC(CN(C1)C(=O)CC2=CC=CC3=CC=CC=C32)C4=NC5=C(C=NN5C(=C4)NCC6=CN=CC=C6)Br

InChI

InChI=1S/C29H27BrN6O/c30-25-18-33-36-27(32-17-20-6-4-12-31-16-20)15-26(34-29(25)36)23-10-5-13-35(19-23)28(37)14-22-9-3-8-21-7-1-2-11-24(21)22/h1-4,6-9,11-12,15-16,18,23,32H,5,10,13-14,17,19H2