N-(4-azanylcyclohexyl)-4-cyano-N-[[3-[(4-fluorophenyl)carbonylamino]phenyl]methyl]benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-cyano-N-[[3-[(4-fluorophenyl)carbonylamino]phenyl]methyl]benzamide Openeye Name: N-(4-aminocyclohexyl)-4-cyano-N-[[3-[(4-fluorobenzoyl)amino]phenyl]methyl]benzamide CAS Name: N-(4-aminocyclohexyl)-4-cyano-N-[[3-[[(4-fluorophenyl)-oxomethyl]amino]phenyl]methyl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-4-cyano-N-[[3-[(4-fluorobenzoyl)amino]phenyl]methyl]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-cyano-N-[3-[(4-fluorobenzoyl)amino]benzyl]benzamide Formula: C28H27FN4O2 MolecularWeight: 470.537983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H27FN4O2/c29-23-10-8-21(9-11-23)27(34)32-25-3-1-2-20(16-25)18-33(26-14-12-24(31)13-15-26)28(35)22-6-4-19(17-30)5-7-22/h1-11,16,24,26H,12-15,18,31H2,(H,32,34)