N-[(2-bromophenyl)methyl]-N-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[(2-bromophenyl)methyl]-N-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[(2-bromophenyl)methyl]-N-methyl-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[(2-bromophenyl)methyl]-N-methyl-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[(2-bromophenyl)methyl]-N-methyl-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(2-bromobenzyl)-1-(6-keto-1H-pyridazin-3-yl)-N-methyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C17H13BrF3N5O2 MolecularWeight: 456.21663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)C(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F

Isomeric SMILES

CN(CC1=CC=CC=C1Br)C(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F

InChI

InChI=1S/C17H13BrF3N5O2/c1-25(9-10-4-2-3-5-12(10)18)16(28)11-8-22-26(15(11)17(19,20)21)13-6-7-14(27)24-23-13/h2-8H,9H2,1H3,(H,24,27)