N-[5-(1,4-diazepan-1-ylcarbonyl)-2-[4-(2-phenylethanoyl)-1,4-diazepan-1-yl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-2-[4-(2-phenylethanoyl)-1,4-diazepan-1-yl]phenyl]cyclohexanecarboxamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]phenyl]cyclohexanecarboxamide CAS Name: N-[5-[1,4-diazepan-1-yl(oxo)methyl]-2-[4-(1-oxo-2-phenylethyl)-1,4-diazepan-1-yl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]phenyl]cyclohexanecarboxamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]phenyl]cyclohexanecarboxamide Formula: C32H43N5O3 MolecularWeight: 545.71552

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCCNCC3)N4CCCN(CC4)C(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCCNCC3)N4CCCN(CC4)C(=O)CC5=CC=CC=C5

InChI

InChI=1S/C32H43N5O3/c38-30(23-25-9-3-1-4-10-25)36-19-8-18-35(21-22-36)29-14-13-27(32(40)37-17-7-15-33-16-20-37)24-28(29)34-31(39)26-11-5-2-6-12-26/h1,3-4,9-10,13-14,24,26,33H,2,5-8,11-12,15-23H2,(H,34,39)