[6-[4-(7H-purin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [6-[4-(7H-purin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [6-[4-(7H-purin-6-yl)piperazin-1-yl]-3-pyridyl]-pyrrolidin-1-yl-methanone CAS Name: [6-[4-(7H-purin-6-yl)-1-piperazinyl]-3-pyridinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [6-[4-(7H-purin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [6-[4-(7H-purin-6-yl)piperazino]-3-pyridyl]-pyrrolidino-methanone Formula: C19H22N8O MolecularWeight: 378.43098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CN=C(C=C2)N3CCN(CC3)C4=NC=NC5=C4NC=N5

Isomeric SMILES

C1CCN(C1)C(=O)C2=CN=C(C=C2)N3CCN(CC3)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C19H22N8O/c28-19(27-5-1-2-6-27)14-3-4-15(20-11-14)25-7-9-26(10-8-25)18-16-17(22-12-21-16)23-13-24-18/h3-4,11-13H,1-2,5-10H2,(H,21,22,23,24)