4-bromanyl-1-methyl-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-methyl-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-1-methyl-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C15H12BrF3N6O MolecularWeight: 429.19459

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)NC2=NN(C=N2)CC3=CC=CC=C3)Br)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)NC2=NN(C=N2)CC3=CC=CC=C3)Br)C(F)(F)F

InChI

InChI=1S/C15H12BrF3N6O/c1-24-12(15(17,18)19)10(16)11(22-24)13(26)21-14-20-8-25(23-14)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,21,23,26)