1-(6-chloranylpyridazin-3-yl)-N-(3,4-dipropoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-(3,4-dipropoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-(3,4-dipropoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-(3,4-dipropoxyphenyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-(3,4-dipropoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-(3,4-dipropoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H21ClF3N5O3 MolecularWeight: 483.87135

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)NC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)Cl)C(F)(F)F)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)NC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)Cl)C(F)(F)F)OCCC

InChI

InChI=1S/C21H21ClF3N5O3/c1-3-9-32-15-6-5-13(11-16(15)33-10-4-2)27-20(31)14-12-26-30(19(14)21(23,24)25)18-8-7-17(22)28-29-18/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,27,31)