N-[2-(diethylamino)-3-methyl-butyl]-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-(diethylamino)-3-methyl-butyl]-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[2-(diethylamino)-3-methyl-butyl]-1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[2-(diethylamino)-3-methylbutyl]-1-(4-methylphenyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(diethylamino)-3-methylbutyl]-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[2-(diethylamino)-3-methyl-butyl]-1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H29F3N4O MolecularWeight: 410.47637

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C)C(F)(F)F)C(C)C

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C)C(F)(F)F)C(C)C

InChI

InChI=1S/C21H29F3N4O/c1-6-27(7-2)18(14(3)4)13-25-20(29)17-12-26-28(19(17)21(22,23)24)16-10-8-15(5)9-11-16/h8-12,14,18H,6-7,13H2,1-5H3,(H,25,29)