ethyl 5-[3-(2-ethylbutanoylamino)phenyl]-1-(3-fluorophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[3-(2-ethylbutanoylamino)phenyl]-1-(3-fluorophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 5-[3-(2-ethylbutanoylamino)phenyl]-1-(3-fluorophenyl)pyrazole-3-carboxylate CAS Name: 5-[3-[(2-ethyl-1-oxobutyl)amino]phenyl]-1-(3-fluorophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(2-ethylbutanoylamino)phenyl]-1-(3-fluorophenyl)pyrazole-3-carboxylate Traditional Name: 5-[3-(2-ethylbutanoylamino)phenyl]-1-(3-fluorophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C24H26FN3O3 MolecularWeight: 423.479943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC=CC(=C1)C2=CC(=NN2C3=CC(=CC=C3)F)C(=O)OCC

Isomeric SMILES

CCC(CC)C(=O)NC1=CC=CC(=C1)C2=CC(=NN2C3=CC(=CC=C3)F)C(=O)OCC

InChI

InChI=1S/C24H26FN3O3/c1-4-16(5-2)23(29)26-19-11-7-9-17(13-19)22-15-21(24(30)31-6-3)27-28(22)20-12-8-10-18(25)14-20/h7-16H,4-6H2,1-3H3,(H,26,29)