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

Systemtic Name: methyl 4-[3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: methyl 4-[3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[3-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxopropyl]amino]-1-ethyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-1-ethyl-pyrazole-3-carboxylic acid methyl ester Formula: C15H17BrF3N5O3 MolecularWeight: 452.22639

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC)NC(=O)CCN2C(=C(C(=N2)C(F)(F)F)Br)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC)NC(=O)CCN2C(=C(C(=N2)C(F)(F)F)Br)C

InChI

InChI=1S/C15H17BrF3N5O3/c1-4-23-7-9(12(21-23)14(26)27-3)20-10(25)5-6-24-8(2)11(16)13(22-24)15(17,18)19/h7H,4-6H2,1-3H3,(H,20,25)