3-(2-methylphenyl)-1-[(4-methylphenyl)methyl]-1-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]urea

Systemtic Name: 3-(2-methylphenyl)-1-[(4-methylphenyl)methyl]-1-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]urea Openeye Name: 3-(o-tolyl)-1-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]-1-(p-tolylmethyl)urea CAS Name: 3-(2-methylphenyl)-1-[(4-methylphenyl)methyl]-1-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]urea IUPAC Name: 3-(2-methylphenyl)-1-[(4-methylphenyl)methyl]-1-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl]urea Traditional Name: 1-(4-methylbenzyl)-3-(o-tolyl)-1-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]urea Formula: C30H28N4OS MolecularWeight: 492.63452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5C

InChI

InChI=1S/C30H28N4OS/c1-22-14-16-24(17-15-22)19-33(30(35)31-27-12-7-6-9-23(27)2)20-25-21-34(26-10-4-3-5-11-26)32-29(25)28-13-8-18-36-28/h3-18,21H,19-20H2,1-2H3,(H,31,35)