N'-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-N-phenethyl-pentanediamide

Systemtic Name: N'-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-N-phenethyl-pentanediamide Openeye Name: N'-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-N-phenethyl-pentanediamide CAS Name: N'-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-N-phenethylpentanediamide IUPAC Name: N'-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-N-phenethylpentanediamide Traditional Name: N'-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-N-phenethyl-glutaramide Formula: C27H34N4O2 MolecularWeight: 446.58446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CCCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CCCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C27H34N4O2/c1-20-13-15-22(16-14-20)31-24(19-23(30-31)27(2,3)4)29-26(33)12-8-11-25(32)28-18-17-21-9-6-5-7-10-21/h5-7,9-10,13-16,19H,8,11-12,17-18H2,1-4H3,(H,28,32)(H,29,33)