1-methyl-N-[4-(3-methylbutanoylamino)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-methyl-N-[4-(3-methylbutanoylamino)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-methyl-N-[4-(3-methylbutanoylamino)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-methyl-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-methyl-N-[4-(3-methylbutanoylamino)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[4-(isovalerylamino)phenyl]-1-methyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C17H19F3N4O2 MolecularWeight: 368.35357

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C)C(F)(F)F

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C)C(F)(F)F

InChI

InChI=1S/C17H19F3N4O2/c1-10(2)8-14(25)22-11-4-6-12(7-5-11)23-16(26)13-9-21-24(3)15(13)17(18,19)20/h4-7,9-10H,8H2,1-3H3,(H,22,25)(H,23,26)