N-(2-azanylcyclohexyl)-3-[(4-tert-butylphenyl)carbonylamino]-4-(pyrrolidin-1-ylmethyl)benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-[(4-tert-butylphenyl)carbonylamino]-4-(pyrrolidin-1-ylmethyl)benzamide Openeye Name: N-(2-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-(pyrrolidin-1-ylmethyl)benzamide CAS Name: N-(2-aminocyclohexyl)-3-[[(4-tert-butylphenyl)-oxomethyl]amino]-4-(1-pyrrolidinylmethyl)benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-(pyrrolidin-1-ylmethyl)benzamide Traditional Name: N-(2-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-(pyrrolidinomethyl)benzamide Formula: C29H40N4O2 MolecularWeight: 476.6535

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCCC4

InChI

InChI=1S/C29H40N4O2/c1-29(2,3)23-14-12-20(13-15-23)27(34)32-26-18-21(10-11-22(26)19-33-16-6-7-17-33)28(35)31-25-9-5-4-8-24(25)30/h10-15,18,24-25H,4-9,16-17,19,30H2,1-3H3,(H,31,35)(H,32,34)