3-cyano-N-[[4-[(phenethylcarbamoylamino)methyl]cyclohexyl]methyl]benzamide

Systemtic Name: 3-cyano-N-[[4-[(phenethylcarbamoylamino)methyl]cyclohexyl]methyl]benzamide Openeye Name: 3-cyano-N-[[4-[(phenethylcarbamoylamino)methyl]cyclohexyl]methyl]benzamide CAS Name: 3-cyano-N-[[4-[[[oxo-(phenethylamino)methyl]amino]methyl]cyclohexyl]methyl]benzamide IUPAC Name: 3-cyano-N-[[4-[(phenethylcarbamoylamino)methyl]cyclohexyl]methyl]benzamide Traditional Name: 3-cyano-N-[[4-[(phenethylcarbamoylamino)methyl]cyclohexyl]methyl]benzamide Formula: C25H30N4O2 MolecularWeight: 418.5313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)C2=CC=CC(=C2)C#N)CNC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CC(CCC1CNC(=O)C2=CC=CC(=C2)C#N)CNC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C25H30N4O2/c26-16-22-7-4-8-23(15-22)24(30)28-17-20-9-11-21(12-10-20)18-29-25(31)27-14-13-19-5-2-1-3-6-19/h1-8,15,20-21H,9-14,17-18H2,(H,28,30)(H2,27,29,31)