N-[4-(3-methylbutanoylamino)phenyl]-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(3-methylbutanoylamino)phenyl]-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-[4-(3-methylbutanoylamino)phenyl]-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-[4-(3-methylbutanoylamino)phenyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-[4-(isovalerylamino)phenyl]-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C26H25N5O2 MolecularWeight: 439.509

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H25N5O2/c1-18(2)15-24(32)28-20-10-12-21(13-11-20)29-26(33)23-17-31(22-8-4-3-5-9-22)30-25(23)19-7-6-14-27-16-19/h3-14,16-18H,15H2,1-2H3,(H,28,32)(H,29,33)