6-azanyl-2-ethoxy-9-[[4-[(4-methoxypiperidin-1-yl)methyl]phenyl]methyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-2-ethoxy-9-[[4-[(4-methoxypiperidin-1-yl)methyl]phenyl]methyl]-7H-purin-8-one Openeye Name: 6-amino-2-ethoxy-9-[[4-[(4-methoxy-1-piperidyl)methyl]phenyl]methyl]-7H-purin-8-one CAS Name: 6-amino-2-ethoxy-9-[[4-[(4-methoxy-1-piperidinyl)methyl]phenyl]methyl]-7H-purin-8-one IUPAC Name: 6-amino-2-ethoxy-9-[[4-[(4-methoxypiperidin-1-yl)methyl]phenyl]methyl]-7H-purin-8-one Traditional Name: 6-amino-2-ethoxy-9-[4-[(4-methoxypiperidino)methyl]benzyl]-7H-purin-8-one Formula: C21H28N6O3 MolecularWeight: 412.48542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=C(C=C3)CN4CCC(CC4)OC

Isomeric SMILES

CCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC=C(C=C3)CN4CCC(CC4)OC

InChI

InChI=1S/C21H28N6O3/c1-3-30-20-24-18(22)17-19(25-20)27(21(28)23-17)13-15-6-4-14(5-7-15)12-26-10-8-16(29-2)9-11-26/h4-7,16H,3,8-13H2,1-2H3,(H,23,28)(H2,22,24,25)