N-[3-[[(4-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]-4-chloranyl-phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-[[(4-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]-4-chloranyl-phenyl]-4-fluoranyl-benzamide Openeye Name: N-[3-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chloro-phenyl]-4-fluoro-benzamide CAS Name: N-[3-[[(4-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]-4-chlorophenyl]-4-fluorobenzamide IUPAC Name: N-[3-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chlorophenyl]-4-fluorobenzamide Traditional Name: N-[3-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chloro-phenyl]-4-fluoro-benzamide Formula: C27H33ClFN3O2 MolecularWeight: 486.021223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)F)Cl)C4CCC(CC4)N

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)F)Cl)C4CCC(CC4)N

InChI

InChI=1S/C27H33ClFN3O2/c28-25-15-12-23(31-26(33)18-6-8-21(29)9-7-18)16-20(25)17-32(24-13-10-22(30)11-14-24)27(34)19-4-2-1-3-5-19/h6-9,12,15-16,19,22,24H,1-5,10-11,13-14,17,30H2,(H,31,33)