3-[bis(fluoranyl)methyl]-N-[2-(5-bromanylpyrimidin-2-yl)ethyl]-1-methyl-pyrazole-4-carboxamide

Systemtic Name: 3-[bis(fluoranyl)methyl]-N-[2-(5-bromanylpyrimidin-2-yl)ethyl]-1-methyl-pyrazole-4-carboxamide Openeye Name: N-[2-(5-bromopyrimidin-2-yl)ethyl]-3-(difluoromethyl)-1-methyl-pyrazole-4-carboxamide CAS Name: N-[2-(5-bromo-2-pyrimidinyl)ethyl]-3-(difluoromethyl)-1-methyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(5-bromopyrimidin-2-yl)ethyl]-3-(difluoromethyl)-1-methylpyrazole-4-carboxamide Traditional Name: N-[2-(5-bromopyrimidin-2-yl)ethyl]-3-(difluoromethyl)-1-methyl-pyrazole-4-carboxamide Formula: C12H12BrF2N5O MolecularWeight: 360.157386

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(F)F)C(=O)NCCC2=NC=C(C=N2)Br

Isomeric SMILES

CN1C=C(C(=N1)C(F)F)C(=O)NCCC2=NC=C(C=N2)Br

InChI

InChI=1S/C12H12BrF2N5O/c1-20-6-8(10(19-20)11(14)15)12(21)16-3-2-9-17-4-7(13)5-18-9/h4-6,11H,2-3H2,1H3,(H,16,21)