ethyl 7-[3-[(4-bromanyl-3-nitro-1H-pyrazol-5-yl)carbonylamino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 7-[3-[(4-bromanyl-3-nitro-1H-pyrazol-5-yl)carbonylamino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 7-[3-[(4-bromo-3-nitro-1H-pyrazole-5-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 7-[3-[[(4-bromo-3-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]phenyl]-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-[(4-bromo-3-nitro-1H-pyrazole-5-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 7-[3-[(4-bromo-3-nitro-1H-pyrazole-5-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C19H14BrN7O5 MolecularWeight: 500.26236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N=CC=C(N2N=C1)C3=CC(=CC=C3)NC(=O)C4=C(C(=NN4)[N+](=O)[O-])Br

Isomeric SMILES

CCOC(=O)C1=C2N=CC=C(N2N=C1)C3=CC(=CC=C3)NC(=O)C4=C(C(=NN4)[N+](=O)[O-])Br

InChI

InChI=1S/C19H14BrN7O5/c1-2-32-19(29)12-9-22-26-13(6-7-21-16(12)26)10-4-3-5-11(8-10)23-18(28)15-14(20)17(25-24-15)27(30)31/h3-9H,2H2,1H3,(H,23,28)(H,24,25)