ethyl 2-(4-bromophenyl)-7-phenyl-pyrazolo[1,5-a]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(4-bromophenyl)-7-phenyl-pyrazolo[1,5-a]pyrimidine-5-carboxylate Openeye Name: ethyl 2-(4-bromophenyl)-7-phenyl-pyrazolo[1,5-a]pyrimidine-5-carboxylate CAS Name: 2-(4-bromophenyl)-7-phenyl-5-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-bromophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-5-carboxylate Traditional Name: 2-(4-bromophenyl)-7-phenyl-pyrazolo[1,5-a]pyrimidine-5-carboxylic acid ethyl ester Formula: C21H16BrN3O2 MolecularWeight: 422.27464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC(=NN2C(=C1)C3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC(=O)C1=NC2=CC(=NN2C(=C1)C3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrN3O2/c1-2-27-21(26)18-12-19(15-6-4-3-5-7-15)25-20(23-18)13-17(24-25)14-8-10-16(22)11-9-14/h3-13H,2H2,1H3