N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide

Systemtic Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Openeye Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide CAS Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)-4-piperidinecarboxamide IUPAC Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Traditional Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)isonipecotamide Formula: C22H25N7O2 MolecularWeight: 419.4796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2CCNC(=O)C3CCN(CC3)C4=NC=NC5=C4NC=N5

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2CCNC(=O)C3CCN(CC3)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C22H25N7O2/c1-31-16-2-3-18-17(10-16)15(11-24-18)4-7-23-22(30)14-5-8-29(9-6-14)21-19-20(26-12-25-19)27-13-28-21/h2-3,10-14,24H,4-9H2,1H3,(H,23,30)(H,25,26,27,28)