1-(2-chloranyl-7H-purin-6-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-7H-purin-6-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(2-chloro-7H-purin-6-yl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-(2-chloro-7H-purin-6-yl)-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-7H-purin-6-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(2-chloro-7H-purin-6-yl)-N-(3-pyridylmethyl)isonipecotamide Formula: C17H18ClN7O MolecularWeight: 371.82412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C3=NC(=NC4=C3NC=N4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C3=NC(=NC4=C3NC=N4)Cl

InChI

InChI=1S/C17H18ClN7O/c18-17-23-14-13(21-10-22-14)15(24-17)25-6-3-12(4-7-25)16(26)20-9-11-2-1-5-19-8-11/h1-2,5,8,10,12H,3-4,6-7,9H2,(H,20,26)(H,21,22,23,24)