methyl 5-(2,4-dichlorophenyl)-3-phenyl-pyrazolo[1,5-a]pyrimidine-7-carboxylate

Systemtic Name: methyl 5-(2,4-dichlorophenyl)-3-phenyl-pyrazolo[1,5-a]pyrimidine-7-carboxylate Openeye Name: methyl 5-(2,4-dichlorophenyl)-3-phenyl-pyrazolo[1,5-a]pyrimidine-7-carboxylate CAS Name: 5-(2,4-dichlorophenyl)-3-phenyl-7-pyrazolo[1,5-a]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 5-(2,4-dichlorophenyl)-3-phenylpyrazolo[1,5-a]pyrimidine-7-carboxylate Traditional Name: 5-(2,4-dichlorophenyl)-3-phenyl-pyrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester Formula: C20H13Cl2N3O2 MolecularWeight: 398.24212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC2=C(C=NN12)C3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC(=NC2=C(C=NN12)C3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H13Cl2N3O2/c1-27-20(26)18-10-17(14-8-7-13(21)9-16(14)22)24-19-15(11-23-25(18)19)12-5-3-2-4-6-12/h2-11H,1H3