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

Systemtic Name: N-[2-(2,4-dichlorophenyl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Openeye Name: N-[2-(2,4-dichlorophenyl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide CAS Name: N-[2-(2,4-dichlorophenyl)ethyl]-1-(7H-purin-6-yl)-4-piperidinecarboxamide IUPAC Name: N-[2-(2,4-dichlorophenyl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Traditional Name: N-[2-(2,4-dichlorophenyl)ethyl]-1-(7H-purin-6-yl)isonipecotamide Formula: C19H20Cl2N6O MolecularWeight: 419.3077

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20Cl2N6O/c20-14-2-1-12(15(21)9-14)3-6-22-19(28)13-4-7-27(8-5-13)18-16-17(24-10-23-16)25-11-26-18/h1-2,9-11,13H,3-8H2,(H,22,28)(H,23,24,25,26)