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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN7O/c21-15-4-2-14(3-5-15)20(29)26-16-6-10-27(11-7-16)8-1-9-28-13-25-17-18(22)23-12-24-19(17)28/h2-5,12-13,16H,1,6-11H2,(H,26,29)(H2,22,23,24)