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

Systemtic Name: 3-(3-fluoranyl-4-methyl-phenyl)-1-[(4-methylphenyl)methyl]-1-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]urea Openeye Name: 3-(3-fluoro-4-methyl-phenyl)-1-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]-1-(p-tolylmethyl)urea CAS Name: 3-(3-fluoro-4-methylphenyl)-1-[(4-methylphenyl)methyl]-1-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]urea IUPAC Name: 3-(3-fluoro-4-methylphenyl)-1-[(4-methylphenyl)methyl]-1-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl]urea Traditional Name: 3-(3-fluoro-4-methyl-phenyl)-1-(4-methylbenzyl)-1-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]urea Formula: C30H27FN4OS MolecularWeight: 510.624983

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(=C(C=C5)C)F

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)NC5=CC(=C(C=C5)C)F

InChI

InChI=1S/C30H27FN4OS/c1-21-10-13-23(14-11-21)18-34(30(36)32-25-15-12-22(2)27(31)17-25)19-24-20-35(26-7-4-3-5-8-26)33-29(24)28-9-6-16-37-28/h3-17,20H,18-19H2,1-2H3,(H,32,36)