1,3-bis[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]urea

Systemtic Name: 1,3-bis[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]urea Openeye Name: 1,3-bis[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]urea CAS Name: 1,3-bis[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]urea IUPAC Name: 1,3-bis[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]urea Traditional Name: 1,3-bis[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]urea Formula: C29H36N6O MolecularWeight: 484.63574

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)NC3=CC(=NN3C4=CC=C(C=C4)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC(=NN3C4=CC=C(C=C4)C)C(C)(C)C

InChI

InChI=1S/C29H36N6O/c1-19-9-13-21(14-10-19)34-25(17-23(32-34)28(3,4)5)30-27(36)31-26-18-24(29(6,7)8)33-35(26)22-15-11-20(2)12-16-22/h9-18H,1-8H3,(H2,30,31,36)