N-(1-adamantyl)-1-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide

Systemtic Name: N-(1-adamantyl)-1-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide Openeye Name: N-(1-adamantyl)-1-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide CAS Name: N-(1-adamantyl)-1-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-1-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide Traditional Name: N-(1-adamantyl)-1-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl]nipecotamide Formula: C25H31BrN4O2 MolecularWeight: 499.44324

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=NC(=NO2)C3=CC(=CC=C3)Br)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CC(CN(C1)CC2=NC(=NO2)C3=CC(=CC=C3)Br)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H31BrN4O2/c26-21-5-1-3-19(10-21)23-27-22(32-29-23)15-30-6-2-4-20(14-30)24(31)28-25-11-16-7-17(12-25)9-18(8-16)13-25/h1,3,5,10,16-18,20H,2,4,6-9,11-15H2,(H,28,31)