ethyl 5-(4-chlorophenyl)-7-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-7-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-7-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 5-(4-chlorophenyl)-7-(3-methoxyphenyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-7-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 5-(4-chlorophenyl)-7-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid ethyl ester Formula: C22H18ClN3O3 MolecularWeight: 407.84962

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClN3O3/c1-3-29-22(27)19-13-21-24-18(14-7-9-16(23)10-8-14)12-20(26(21)25-19)15-5-4-6-17(11-15)28-2/h4-13H,3H2,1-2H3