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

Systemtic Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[4-(isobutyrylamino)benzyl]-1-phenyl-pyrazole-4-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)CNC(=O)C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)CNC(=O)C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2/c1-15(2)20(26)24-18-10-8-16(9-11-18)12-22-21(27)17-13-23-25(14-17)19-6-4-3-5-7-19/h3-11,13-15H,12H2,1-2H3,(H,22,27)(H,24,26)