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

Systemtic Name: N-[1-[3-(6-aminopurin-9-yl)propyl]piperidin-4-yl]-4-(phenylmethyl)benzamide Openeye Name: N-[1-[3-(6-aminopurin-9-yl)propyl]-4-piperidyl]-4-benzyl-benzamide CAS Name: N-[1-[3-(6-aminopurin-9-yl)propyl]-4-piperidinyl]-4-(phenylmethyl)benzamide IUPAC Name: N-[1-[3-(6-aminopurin-9-yl)propyl]piperidin-4-yl]-4-benzylbenzamide Traditional Name: N-[1-(3-adenin-9-ylpropyl)-4-piperidyl]-4-benzyl-benzamide Formula: C27H31N7O MolecularWeight: 469.58134

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)CC3=CC=CC=C3)CCCN4C=NC5=C4N=CN=C5N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)CC3=CC=CC=C3)CCCN4C=NC5=C4N=CN=C5N

InChI

InChI=1S/C27H31N7O/c28-25-24-26(30-18-29-25)34(19-31-24)14-4-13-33-15-11-23(12-16-33)32-27(35)22-9-7-21(8-10-22)17-20-5-2-1-3-6-20/h1-3,5-10,18-19,23H,4,11-17H2,(H,32,35)(H2,28,29,30)