4-butyl-N-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]benzamide

Systemtic Name: 4-butyl-N-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]benzamide Openeye Name: 4-butyl-N-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]benzamide CAS Name: 4-butyl-N-[2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolyl]benzamide IUPAC Name: 4-butyl-N-[2-(2,4-dimethylphenyl)-5-phenylpyrazol-3-yl]benzamide Traditional Name: 4-butyl-N-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]benzamide Formula: C28H29N3O MolecularWeight: 423.54936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2=CC(=NN2C3=C(C=C(C=C3)C)C)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC(=NN2C3=C(C=C(C=C3)C)C)C4=CC=CC=C4

InChI

InChI=1S/C28H29N3O/c1-4-5-9-22-13-15-24(16-14-22)28(32)29-27-19-25(23-10-7-6-8-11-23)30-31(27)26-17-12-20(2)18-21(26)3/h6-8,10-19H,4-5,9H2,1-3H3,(H,29,32)