N-[1-[3-(6-aminopurin-9-yl)propyl]piperidin-4-yl]-3-chloranyl-benzamide

Systemtic Name: N-[1-[3-(6-aminopurin-9-yl)propyl]piperidin-4-yl]-3-chloranyl-benzamide Openeye Name: N-[1-[3-(6-aminopurin-9-yl)propyl]-4-piperidyl]-3-chloro-benzamide CAS Name: N-[1-[3-(6-aminopurin-9-yl)propyl]-4-piperidinyl]-3-chlorobenzamide IUPAC Name: N-[1-[3-(6-aminopurin-9-yl)propyl]piperidin-4-yl]-3-chlorobenzamide Traditional Name: N-[1-(3-adenin-9-ylpropyl)-4-piperidyl]-3-chloro-benzamide Formula: C20H24ClN7O MolecularWeight: 413.90386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC(=CC=C2)Cl)CCCN3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC(=CC=C2)Cl)CCCN3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C20H24ClN7O/c21-15-4-1-3-14(11-15)20(29)26-16-5-9-27(10-6-16)7-2-8-28-13-25-17-18(22)23-12-24-19(17)28/h1,3-4,11-13,16H,2,5-10H2,(H,26,29)(H2,22,23,24)