N-(4-azanylcyclohexyl)-3-[(4-tert-butylphenyl)carbonylamino]-4-(4-cyclohexylcarbonyl-1,4-diazepan-1-yl)benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(4-tert-butylphenyl)carbonylamino]-4-(4-cyclohexylcarbonyl-1,4-diazepan-1-yl)benzamide Openeye Name: N-(4-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-[[(4-tert-butylphenyl)-oxomethyl]amino]-4-[4-[cyclohexyl(oxo)methyl]-1,4-diazepan-1-yl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]benzamide Formula: C36H51N5O3 MolecularWeight: 601.82184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCC(CC3)N)N4CCCN(CC4)C(=O)C5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCC(CC3)N)N4CCCN(CC4)C(=O)C5CCCCC5

InChI

InChI=1S/C36H51N5O3/c1-36(2,3)28-13-10-25(11-14-28)33(42)39-31-24-27(34(43)38-30-17-15-29(37)16-18-30)12-19-32(31)40-20-7-21-41(23-22-40)35(44)26-8-5-4-6-9-26/h10-14,19,24,26,29-30H,4-9,15-18,20-23,37H2,1-3H3,(H,38,43)(H,39,42)