N-(2-chlorophenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide

Systemtic Name: N-(2-chlorophenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide Openeye Name: N-(2-chlorophenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide CAS Name: N-(2-chlorophenyl)-1-(7H-purin-6-yl)-4-piperidinecarboxamide IUPAC Name: N-(2-chlorophenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide Traditional Name: N-(2-chlorophenyl)-1-(7H-purin-6-yl)isonipecotamide Formula: C17H17ClN6O MolecularWeight: 356.80948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2Cl)C3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2Cl)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C17H17ClN6O/c18-12-3-1-2-4-13(12)23-17(25)11-5-7-24(8-6-11)16-14-15(20-9-19-14)21-10-22-16/h1-4,9-11H,5-8H2,(H,23,25)(H,19,20,21,22)