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

Systemtic Name: ethyl 5-(4-chlorophenyl)-7-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-7-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 5-(4-chlorophenyl)-7-phenyl-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 5-(4-chlorophenyl)-7-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid ethyl ester Formula: C21H16ClN3O2 MolecularWeight: 377.82364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16ClN3O2/c1-2-27-21(26)18-13-20-23-17(14-8-10-16(22)11-9-14)12-19(25(20)24-18)15-6-4-3-5-7-15/h3-13H,2H2,1H3