(phenylmethyl) 4-[3-bromanyl-7-(pyridin-4-ylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-bromanyl-7-(pyridin-4-ylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-bromo-7-(4-pyridylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate CAS Name: 4-[3-bromo-7-(pyridin-4-ylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-bromo-7-(pyridin-4-ylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate Traditional Name: 4-[3-bromo-7-(4-pyridylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylic acid benzyl ester Formula: C24H23BrN6O2 MolecularWeight: 507.38242

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=C(C=NN3C(=C2)NC4=CC=NC=C4)Br)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC3=C(C=NN3C(=C2)NC4=CC=NC=C4)Br)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C24H23BrN6O2/c25-20-15-27-31-22(28-19-6-10-26-11-7-19)14-21(29-23(20)31)18-8-12-30(13-9-18)24(32)33-16-17-4-2-1-3-5-17/h1-7,10-11,14-15,18H,8-9,12-13,16H2,(H,26,28)