ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-(4-propoxycarbonylphenoxy)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-(4-propoxycarbonylphenoxy)pyrimidine-5-carboxylate Openeye Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-(4-propoxycarbonylphenoxy)pyrimidine-5-carboxylate CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-4-[4-[oxo(propoxy)methyl]phenoxy]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-(4-propoxycarbonylphenoxy)pyrimidine-5-carboxylate Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-4-(4-propoxycarbonylphenoxy)pyrimidine-5-carboxylic acid ethyl ester Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=NC(=NC=C2C(=O)OCC)N3C(=CC(=N3)C)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=NC(=NC=C2C(=O)OCC)N3C(=CC(=N3)C)C

InChI

InChI=1S/C22H24N4O5/c1-5-11-30-20(27)16-7-9-17(10-8-16)31-19-18(21(28)29-6-2)13-23-22(24-19)26-15(4)12-14(3)25-26/h7-10,12-13H,5-6,11H2,1-4H3