N-(2-azanylcyclohexyl)-N-[[4-[(4-tert-butylphenyl)carbonylamino]phenyl]methyl]-3,5-bis(fluoranyl)benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-N-[[4-[(4-tert-butylphenyl)carbonylamino]phenyl]methyl]-3,5-bis(fluoranyl)benzamide Openeye Name: N-(2-aminocyclohexyl)-N-[[4-[(4-tert-butylbenzoyl)amino]phenyl]methyl]-3,5-difluoro-benzamide CAS Name: N-(2-aminocyclohexyl)-N-[[4-[[(4-tert-butylphenyl)-oxomethyl]amino]phenyl]methyl]-3,5-difluorobenzamide IUPAC Name: N-(2-aminocyclohexyl)-N-[[4-[(4-tert-butylbenzoyl)amino]phenyl]methyl]-3,5-difluorobenzamide Traditional Name: N-(2-aminocyclohexyl)-N-[4-[(4-tert-butylbenzoyl)amino]benzyl]-3,5-difluoro-benzamide Formula: C31H35F2N3O2 MolecularWeight: 519.625306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CN(C3CCCCC3N)C(=O)C4=CC(=CC(=C4)F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CN(C3CCCCC3N)C(=O)C4=CC(=CC(=C4)F)F

InChI

InChI=1S/C31H35F2N3O2/c1-31(2,3)23-12-10-21(11-13-23)29(37)35-26-14-8-20(9-15-26)19-36(28-7-5-4-6-27(28)34)30(38)22-16-24(32)18-25(33)17-22/h8-18,27-28H,4-7,19,34H2,1-3H3,(H,35,37)