4-bromanyl-2-ethyl-N-[1-[2,2,2-tris(fluoranyl)ethoxymethyl]pyrazol-4-yl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-ethyl-N-[1-[2,2,2-tris(fluoranyl)ethoxymethyl]pyrazol-4-yl]pyrazole-3-carboxamide Openeye Name: 4-bromo-2-ethyl-N-[1-(2,2,2-trifluoroethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 4-bromo-2-ethyl-N-[1-(2,2,2-trifluoroethoxymethyl)-4-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-ethyl-N-[1-(2,2,2-trifluoroethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide Traditional Name: 4-bromo-2-ethyl-N-[1-(2,2,2-trifluoroethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide Formula: C12H13BrF3N5O2 MolecularWeight: 396.16313

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=CN(N=C2)COCC(F)(F)F

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=CN(N=C2)COCC(F)(F)F

InChI

InChI=1S/C12H13BrF3N5O2/c1-2-21-10(9(13)4-18-21)11(22)19-8-3-17-20(5-8)7-23-6-12(14,15)16/h3-5H,2,6-7H2,1H3,(H,19,22)