propyl 4-[6-(4-ethanoyl-5-methyl-pyrazol-1-yl)-2-methyl-pyrimidin-4-yl]oxybenzoate

Systemtic Name: propyl 4-[6-(4-ethanoyl-5-methyl-pyrazol-1-yl)-2-methyl-pyrimidin-4-yl]oxybenzoate Openeye Name: propyl 4-[6-(4-acetyl-5-methyl-pyrazol-1-yl)-2-methyl-pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[6-(4-acetyl-5-methyl-1-pyrazolyl)-2-methyl-4-pyrimidinyl]oxy]benzoic acid propyl ester IUPAC Name: propyl 4-[6-(4-acetyl-5-methylpyrazol-1-yl)-2-methylpyrimidin-4-yl]oxybenzoate Traditional Name: 4-[6-(4-acetyl-5-methyl-pyrazol-1-yl)-2-methyl-pyrimidin-4-yl]oxybenzoic acid propyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=NC(=NC(=C2)N3C(=C(C=N3)C(=O)C)C)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=NC(=NC(=C2)N3C(=C(C=N3)C(=O)C)C)C

InChI

InChI=1S/C21H22N4O4/c1-5-10-28-21(27)16-6-8-17(9-7-16)29-20-11-19(23-15(4)24-20)25-13(2)18(12-22-25)14(3)26/h6-9,11-12H,5,10H2,1-4H3