N-[1-[3-(6-azanyl-2-phenyl-purin-9-yl)propyl]piperidin-4-yl]benzamide

Systemtic Name: N-[1-[3-(6-azanyl-2-phenyl-purin-9-yl)propyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[3-(6-amino-2-phenyl-purin-9-yl)propyl]-4-piperidyl]benzamide CAS Name: N-[1-[3-(6-amino-2-phenyl-9-purinyl)propyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[3-(6-amino-2-phenylpurin-9-yl)propyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[3-(6-amino-2-phenyl-purin-9-yl)propyl]-4-piperidyl]benzamide Formula: C26H29N7O MolecularWeight: 455.55476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=CC=C2)CCCN3C=NC4=C3N=C(N=C4N)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=CC=C2)CCCN3C=NC4=C3N=C(N=C4N)C5=CC=CC=C5

InChI

InChI=1S/C26H29N7O/c27-23-22-25(31-24(30-23)19-8-3-1-4-9-19)33(18-28-22)15-7-14-32-16-12-21(13-17-32)29-26(34)20-10-5-2-6-11-20/h1-6,8-11,18,21H,7,12-17H2,(H,29,34)(H2,27,30,31)