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

Systemtic Name: 1-(6-oxidanylidene-1H-pyridazin-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(6-oxo-1H-pyridazin-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(6-oxo-1H-pyridazin-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(4-isopropoxybenzyl)-1-(6-keto-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C19H18F3N5O3 MolecularWeight: 421.37313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F

InChI

InChI=1S/C19H18F3N5O3/c1-11(2)30-13-5-3-12(4-6-13)9-23-18(29)14-10-24-27(17(14)19(20,21)22)15-7-8-16(28)26-25-15/h3-8,10-11H,9H2,1-2H3,(H,23,29)(H,26,28)