N-[2-chloranyl-5-(1,4-diazepan-1-ylcarbonyl)phenyl]-N-cyclohexylcarbonyl-cyclohexanecarboxamide

Systemtic Name: N-[2-chloranyl-5-(1,4-diazepan-1-ylcarbonyl)phenyl]-N-cyclohexylcarbonyl-cyclohexanecarboxamide Openeye Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-N-(cyclohexanecarbonyl)cyclohexanecarboxamide CAS Name: N-[2-chloro-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]-N-[cyclohexyl(oxo)methyl]cyclohexanecarboxamide IUPAC Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-N-(cyclohexanecarbonyl)cyclohexanecarboxamide Traditional Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-N-(cyclohexanecarbonyl)cyclohexanecarboxamide Formula: C26H36ClN3O3 MolecularWeight: 474.03534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(C2=C(C=CC(=C2)C(=O)N3CCCNCC3)Cl)C(=O)C4CCCCC4

Isomeric SMILES

C1CCC(CC1)C(=O)N(C2=C(C=CC(=C2)C(=O)N3CCCNCC3)Cl)C(=O)C4CCCCC4

InChI

InChI=1S/C26H36ClN3O3/c27-22-13-12-21(24(31)29-16-7-14-28-15-17-29)18-23(22)30(25(32)19-8-3-1-4-9-19)26(33)20-10-5-2-6-11-20/h12-13,18-20,28H,1-11,14-17H2