1-(4-methylphenyl)-N-[2-(2-methylpropanoylamino)ethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)-N-[2-(2-methylpropanoylamino)ethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1-(4-methylphenyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-methylphenyl)-N-[2-(2-methylpropanoylamino)ethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C18H21F3N4O2 MolecularWeight: 382.38015

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCNC(=O)C(C)C)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCNC(=O)C(C)C)C(F)(F)F

InChI

InChI=1S/C18H21F3N4O2/c1-11(2)16(26)22-8-9-23-17(27)14-10-24-25(15(14)18(19,20)21)13-6-4-12(3)5-7-13/h4-7,10-11H,8-9H2,1-3H3,(H,22,26)(H,23,27)