methyl 3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-2-methyl-propanoate

Systemtic Name: methyl 3-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-2-methyl-propanoate Openeye Name: methyl 3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-2-methyl-propanoate CAS Name: 3-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpropanoate Traditional Name: 3-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-2-methyl-propionic acid methyl ester Formula: C17H18BrN5O2 MolecularWeight: 404.26112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC2=C(C=NN2C(=C1)NCC3=CN=CC=C3)Br)C(=O)OC

Isomeric SMILES

CC(CC1=NC2=C(C=NN2C(=C1)NCC3=CN=CC=C3)Br)C(=O)OC

InChI

InChI=1S/C17H18BrN5O2/c1-11(17(24)25-2)6-13-7-15(20-9-12-4-3-5-19-8-12)23-16(22-13)14(18)10-21-23/h3-5,7-8,10-11,20H,6,9H2,1-2H3