N-(4-bromanyl-3-methyl-phenyl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-(6-methoxy-3-pyridazinyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C17H13BrF3N5O2 MolecularWeight: 456.21663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)OC)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)OC)C(F)(F)F)Br

InChI

InChI=1S/C17H13BrF3N5O2/c1-9-7-10(3-4-12(9)18)23-16(27)11-8-22-26(15(11)17(19,20)21)13-5-6-14(28-2)25-24-13/h3-8H,1-2H3,(H,23,27)