N-[3-(4-bromanylpyrazol-1-yl)propyl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: N-[3-(4-bromopyrazol-1-yl)propyl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: N-[3-(4-bromo-1-pyrazolyl)propyl]-1-methyl-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-bromopyrazol-1-yl)propyl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: N-[3-(4-bromopyrazol-1-yl)propyl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C12H13BrF3N5O MolecularWeight: 380.16373

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(=O)NCCCN2C=C(C=N2)Br)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=N1)C(=O)NCCCN2C=C(C=N2)Br)C(F)(F)F

InChI

InChI=1S/C12H13BrF3N5O/c1-20-10(12(14,15)16)5-9(19-20)11(22)17-3-2-4-21-7-8(13)6-18-21/h5-7H,2-4H2,1H3,(H,17,22)