N-[3-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]-4-tert-butyl-benzamide

Systemtic Name: N-[3-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]-4-tert-butyl-benzamide CAS Name: N-[3-[[(2-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]-4-tert-butylbenzamide Traditional Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]-4-tert-butyl-benzamide Formula: C31H43N3O2 MolecularWeight: 489.69202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)CN(C3CCCCC3N)C(=O)C4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)CN(C3CCCCC3N)C(=O)C4CCCCC4

InChI

InChI=1S/C31H43N3O2/c1-31(2,3)25-18-16-23(17-19-25)29(35)33-26-13-9-10-22(20-26)21-34(28-15-8-7-14-27(28)32)30(36)24-11-5-4-6-12-24/h9-10,13,16-20,24,27-28H,4-8,11-12,14-15,21,32H2,1-3H3,(H,33,35)