N-[3,5-bis(trifluoromethyl)phenyl]-4-bromanyl-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-bromanyl-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-bromo-2-methyl-pyrazole-3-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-bromo-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-bromo-2-methylpyrazole-3-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-bromo-2-methyl-pyrazole-3-carboxamide Formula: C13H8BrF6N3O MolecularWeight: 416.116539

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C13H8BrF6N3O/c1-23-10(9(14)5-21-23)11(24)22-8-3-6(12(15,16)17)2-7(4-8)13(18,19)20/h2-5H,1H3,(H,22,24)