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

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-1-(7H-purin-6-yl)-4-piperidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-1-(7H-purin-6-yl)isonipecotamide Formula: C19H21ClN6O MolecularWeight: 384.86264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=CC=C(C=C2)Cl)C3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=CC=C(C=C2)Cl)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C19H21ClN6O/c20-15-3-1-13(2-4-15)5-8-21-19(27)14-6-9-26(10-7-14)18-16-17(23-11-22-16)24-12-25-18/h1-4,11-12,14H,5-10H2,(H,21,27)(H,22,23,24,25)