ethyl 1-(2,5-dimethylphenyl)-5-[(1,2-oxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(2,5-dimethylphenyl)-5-[(1,2-oxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-(2,5-dimethylphenyl)-5-[(isoxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylate CAS Name: 1-(2,5-dimethylphenyl)-5-[(3-isoxazolylmethylamino)methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,5-dimethylphenyl)-5-[(1,2-oxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylate Traditional Name: 1-(2,5-dimethylphenyl)-5-[(isoxazol-3-ylmethylamino)methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=C(C=CC(=C2)C)C)CNCC3=NOC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=C(C=CC(=C2)C)C)CNCC3=NOC=C3

InChI

InChI=1S/C19H22N4O3/c1-4-25-19(24)16-11-21-23(17-9-13(2)5-6-14(17)3)18(16)12-20-10-15-7-8-26-22-15/h5-9,11,20H,4,10,12H2,1-3H3