4-bromanyl-1-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-1-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-1-methyl-N-[3-(1-pyrazolylmethyl)phenyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-1-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C16H13BrF3N5O MolecularWeight: 428.20653

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)NC2=CC=CC(=C2)CN3C=CC=N3)Br)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)NC2=CC=CC(=C2)CN3C=CC=N3)Br)C(F)(F)F

InChI

InChI=1S/C16H13BrF3N5O/c1-24-14(16(18,19)20)12(17)13(23-24)15(26)22-11-5-2-4-10(8-11)9-25-7-3-6-21-25/h2-8H,9H2,1H3,(H,22,26)