5-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-methyl-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-5-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

InChI

InChI=1S/C22H24N4O2/c1-15(2)21(27)25-18-9-7-8-17(12-18)13-23-22(28)20-14-24-26(16(20)3)19-10-5-4-6-11-19/h4-12,14-15H,13H2,1-3H3,(H,23,28)(H,25,27)