N-(4-azanylcyclohexyl)-4-(4-cyclopentylcarbonyl-1,4-diazepan-1-yl)-3-(2-phenylethanoylamino)benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-(4-cyclopentylcarbonyl-1,4-diazepan-1-yl)-3-(2-phenylethanoylamino)benzamide Openeye Name: N-(4-aminocyclohexyl)-4-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-3-[(2-phenylacetyl)amino]benzamide CAS Name: N-(4-aminocyclohexyl)-4-[4-[cyclopentyl(oxo)methyl]-1,4-diazepan-1-yl]-3-[(1-oxo-2-phenylethyl)amino]benzamide IUPAC Name: N-(4-aminocyclohexyl)-4-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-3-[(2-phenylacetyl)amino]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-3-[(2-phenylacetyl)amino]benzamide Formula: C32H43N5O3 MolecularWeight: 545.71552

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CCCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)C(=O)N2CCCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C32H43N5O3/c33-26-12-14-27(15-13-26)34-31(39)25-11-16-29(28(22-25)35-30(38)21-23-7-2-1-3-8-23)36-17-6-18-37(20-19-36)32(40)24-9-4-5-10-24/h1-3,7-8,11,16,22,24,26-27H,4-6,9-10,12-15,17-21,33H2,(H,34,39)(H,35,38)