N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide

Systemtic Name: N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Openeye Name: N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide CAS Name: N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-1-(7H-purin-6-yl)-4-piperidinecarboxamide IUPAC Name: N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Traditional Name: N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-1-(7H-purin-6-yl)isonipecotamide Formula: C21H22N8O2 MolecularWeight: 418.45178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=NC(=NO2)C3=CC=CC=C3)C4=NC=NC5=C4NC=N5

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=NC(=NO2)C3=CC=CC=C3)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C21H22N8O2/c30-21(22-9-6-16-27-18(28-31-16)14-4-2-1-3-5-14)15-7-10-29(11-8-15)20-17-19(24-12-23-17)25-13-26-20/h1-5,12-13,15H,6-11H2,(H,22,30)(H,23,24,25,26)