ethyl 7-cyano-2,5-dimethyl-3-(2,4,6-trimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 7-cyano-2,5-dimethyl-3-(2,4,6-trimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 7-cyano-2,5-dimethyl-3-(2,4,6-trimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-cyano-2,5-dimethyl-3-(2,4,6-trimethylphenyl)-6-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-cyano-2,5-dimethyl-3-(2,4,6-trimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-cyano-3-mesityl-2,5-dimethyl-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(=C(C(=N2)C)C3=C(C=C(C=C3C)C)C)N=C1C)C#N

Isomeric SMILES

CCOC(=O)C1=C(N2C(=C(C(=N2)C)C3=C(C=C(C=C3C)C)C)N=C1C)C#N

InChI

InChI=1S/C21H22N4O2/c1-7-27-21(26)18-14(5)23-20-19(15(6)24-25(20)16(18)10-22)17-12(3)8-11(2)9-13(17)4/h8-9H,7H2,1-6H3