4-[3-bromanyl-7-(pyridin-4-ylmethoxy)pyrazolo[1,5-a]pyrimidin-5-yl]butan-2-yl ethanoate

Systemtic Name: 4-[3-bromanyl-7-(pyridin-4-ylmethoxy)pyrazolo[1,5-a]pyrimidin-5-yl]butan-2-yl ethanoate Openeye Name: [3-[3-bromo-7-(4-pyridylmethoxy)pyrazolo[1,5-a]pyrimidin-5-yl]-1-methyl-propyl] acetate CAS Name: acetic acid 4-[3-bromo-7-(pyridin-4-ylmethoxy)-5-pyrazolo[1,5-a]pyrimidinyl]butan-2-yl ester IUPAC Name: 4-[3-bromo-7-(pyridin-4-ylmethoxy)pyrazolo[1,5-a]pyrimidin-5-yl]butan-2-yl acetate Traditional Name: acetic acid [3-[3-bromo-7-(4-pyridylmethoxy)pyrazolo[1,5-a]pyrimidin-5-yl]-1-methyl-propyl] ester Formula: C18H19BrN4O3 MolecularWeight: 419.27246

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=NC2=C(C=NN2C(=C1)OCC3=CC=NC=C3)Br)OC(=O)C

Isomeric SMILES

CC(CCC1=NC2=C(C=NN2C(=C1)OCC3=CC=NC=C3)Br)OC(=O)C

InChI

InChI=1S/C18H19BrN4O3/c1-12(26-13(2)24)3-4-15-9-17(23-18(22-15)16(19)10-21-23)25-11-14-5-7-20-8-6-14/h5-10,12H,3-4,11H2,1-2H3