ethyl 5-[3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxopropyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C22H21BrF3N5O3 MolecularWeight: 540.33305

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCN3C(=C(C(=N3)C(F)(F)F)Br)C4CC4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCN3C(=C(C(=N3)C(F)(F)F)Br)C4CC4

InChI

InChI=1S/C22H21BrF3N5O3/c1-2-34-21(33)15-12-27-31(14-6-4-3-5-7-14)20(15)28-16(32)10-11-30-18(13-8-9-13)17(23)19(29-30)22(24,25)26/h3-7,12-13H,2,8-11H2,1H3,(H,28,32)