5-[(4-tert-butylphenyl)carbonylamino]-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide

Systemtic Name: 5-[(4-tert-butylphenyl)carbonylamino]-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Openeye Name: 5-[(4-tert-butylbenzoyl)amino]-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide CAS Name: 5-[[(4-tert-butylphenyl)-oxomethyl]amino]-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide IUPAC Name: 5-[(4-tert-butylbenzoyl)amino]-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Traditional Name: 5-[(4-tert-butylbenzoyl)amino]-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Formula: C33H39N3O2 MolecularWeight: 509.68166

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)N3CCC4=CC=CC=C4C3)C(=O)NC5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NC5CCCCC5

InChI

InChI=1S/C33H39N3O2/c1-33(2,3)26-15-13-24(14-16-26)31(37)35-28-17-18-30(36-20-19-23-9-7-8-10-25(23)22-36)29(21-28)32(38)34-27-11-5-4-6-12-27/h7-10,13-18,21,27H,4-6,11-12,19-20,22H2,1-3H3,(H,34,38)(H,35,37)