6-azanyl-2-(2-methoxyethoxy)-9-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(2-methoxyethoxy)-9-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]-7H-purin-8-one Openeye Name: 6-amino-9-[2-(1-benzyl-4-piperidyl)ethyl]-2-(2-methoxyethoxy)-7H-purin-8-one CAS Name: 6-amino-2-(2-methoxyethoxy)-9-[2-[1-(phenylmethyl)-4-piperidinyl]ethyl]-7H-purin-8-one IUPAC Name: 6-amino-9-[2-(1-benzylpiperidin-4-yl)ethyl]-2-(2-methoxyethoxy)-7H-purin-8-one Traditional Name: 6-amino-9-[2-(1-benzyl-4-piperidyl)ethyl]-2-(2-methoxyethoxy)-7H-purin-8-one Formula: C22H30N6O3 MolecularWeight: 426.512

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H30N6O3/c1-30-13-14-31-21-25-19(23)18-20(26-21)28(22(29)24-18)12-9-16-7-10-27(11-8-16)15-17-5-3-2-4-6-17/h2-6,16H,7-15H2,1H3,(H,24,29)(H2,23,25,26)