N-(1-adamantyl)-N-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]-2-(4-oxidanylideneazetidin-2-yl)carbonyl-piperidine-2-carboxamide

Systemtic Name: N-(1-adamantyl)-N-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]-2-(4-oxidanylideneazetidin-2-yl)carbonyl-piperidine-2-carboxamide Openeye Name: N-(1-adamantyl)-N-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-2-(4-oxoazetidine-2-carbonyl)piperidine-2-carboxamide CAS Name: N-(1-adamantyl)-N-[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]-2-[oxo-(4-oxo-2-azetidinyl)methyl]-2-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-N-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-2-(4-oxoazetidine-2-carbonyl)piperidine-2-carboxamide Traditional Name: N-(1-adamantyl)-N-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-2-(4-ketoazetidine-2-carbonyl)pipecolinamide Formula: C26H36N6O4 MolecularWeight: 496.60184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)(C(=O)C2CC(=O)N2)C(=O)N(C(=O)C(CC3=CN=CN3)N)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCNC(C1)(C(=O)C2CC(=O)N2)C(=O)N(C(=O)C(CC3=CN=CN3)N)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H36N6O4/c27-19(8-18-13-28-14-29-18)23(35)32(25-10-15-5-16(11-25)7-17(6-15)12-25)24(36)26(3-1-2-4-30-26)22(34)20-9-21(33)31-20/h13-17,19-20,30H,1-12,27H2,(H,28,29)(H,31,33)