[2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl] 2-phenylbutanoate

Systemtic Name: [2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl] 2-phenylbutanoate Openeye Name: [2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [2-(4,6-dimethyl-2-pyrimidinyl)-4-ethyl-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methylpyrazol-3-yl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [2-(4,6-dimethylpyrimidin-2-yl)-4-ethyl-5-methyl-pyrazol-3-yl] ester Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C)C2=NC(=CC(=N2)C)C)OC(=O)C(CC)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(N(N=C1C)C2=NC(=CC(=N2)C)C)OC(=O)C(CC)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2/c1-6-18-16(5)25-26(22-23-14(3)13-15(4)24-22)20(18)28-21(27)19(7-2)17-11-9-8-10-12-17/h8-13,19H,6-7H2,1-5H3