N-[2-[[1-(7H-purin-6-yl)piperidin-4-yl]carbonylamino]ethyl]pyridine-4-carboxamide

Systemtic Name: N-[2-[[1-(7H-purin-6-yl)piperidin-4-yl]carbonylamino]ethyl]pyridine-4-carboxamide Openeye Name: N-[2-[[1-(7H-purin-6-yl)piperidine-4-carbonyl]amino]ethyl]pyridine-4-carboxamide CAS Name: N-[2-[[oxo-[1-(7H-purin-6-yl)-4-piperidinyl]methyl]amino]ethyl]-4-pyridinecarboxamide IUPAC Name: N-[2-[[1-(7H-purin-6-yl)piperidine-4-carbonyl]amino]ethyl]pyridine-4-carboxamide Traditional Name: N-[2-[[1-(7H-purin-6-yl)isonipecotoyl]amino]ethyl]isonicotinamide Formula: C19H22N8O2 MolecularWeight: 394.43038

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCNC(=O)C2=CC=NC=C2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CN(CCC1C(=O)NCCNC(=O)C2=CC=NC=C2)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C19H22N8O2/c28-18(13-1-5-20-6-2-13)21-7-8-22-19(29)14-3-9-27(10-4-14)17-15-16(24-11-23-15)25-12-26-17/h1-2,5-6,11-12,14H,3-4,7-10H2,(H,21,28)(H,22,29)(H,23,24,25,26)