1-[2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-3-cyclohexyl-urea

Systemtic Name: 1-[2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-3-cyclohexyl-urea Openeye Name: 1-[2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]-3-cyclohexyl-urea CAS Name: 1-[2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]-3-cyclohexylurea IUPAC Name: 1-[2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]-3-cyclohexylurea Traditional Name: 1-[2-[4-[bis(4-fluorophenyl)methyl]piperazino]-5-(piperazine-1-carbonyl)phenyl]-3-cyclohexyl-urea Formula: C35H42F2N6O2 MolecularWeight: 616.743786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCN(CC4)C(C5=CC=C(C=C5)F)C6=CC=C(C=C6)F

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCN(CC4)C(C5=CC=C(C=C5)F)C6=CC=C(C=C6)F

InChI

InChI=1S/C35H42F2N6O2/c36-28-11-6-25(7-12-28)33(26-8-13-29(37)14-9-26)42-22-20-41(21-23-42)32-15-10-27(34(44)43-18-16-38-17-19-43)24-31(32)40-35(45)39-30-4-2-1-3-5-30/h6-15,24,30,33,38H,1-5,16-23H2,(H2,39,40,45)