N-[4-[[(4-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-4-cyano-benzamide

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-4-cyano-benzamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-4-cyano-benzamide CAS Name: N-[4-[[(4-aminocyclohexyl)-benzoylamino]methyl]phenyl]-4-cyanobenzamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-benzoylamino]methyl]phenyl]-4-cyanobenzamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-4-cyano-benzamide Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28N4O2/c29-18-20-6-10-22(11-7-20)27(33)31-25-14-8-21(9-15-25)19-32(26-16-12-24(30)13-17-26)28(34)23-4-2-1-3-5-23/h1-11,14-15,24,26H,12-13,16-17,19,30H2,(H,31,33)