6-azanyl-9-[[3-[(cyclopropylmethylamino)methyl]phenyl]methyl]-2-(2-methoxyethoxy)-7H-purin-8-one

Systemtic Name: 6-azanyl-9-[[3-[(cyclopropylmethylamino)methyl]phenyl]methyl]-2-(2-methoxyethoxy)-7H-purin-8-one Openeye Name: 6-amino-9-[[3-[(cyclopropylmethylamino)methyl]phenyl]methyl]-2-(2-methoxyethoxy)-7H-purin-8-one CAS Name: 6-amino-9-[[3-[(cyclopropylmethylamino)methyl]phenyl]methyl]-2-(2-methoxyethoxy)-7H-purin-8-one IUPAC Name: 6-amino-9-[[3-[(cyclopropylmethylamino)methyl]phenyl]methyl]-2-(2-methoxyethoxy)-7H-purin-8-one Traditional Name: 6-amino-9-[3-[(cyclopropylmethylamino)methyl]benzyl]-2-(2-methoxyethoxy)-7H-purin-8-one Formula: C20H26N6O3 MolecularWeight: 398.45884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC(=CC=C3)CNCC4CC4

Isomeric SMILES

COCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CC(=CC=C3)CNCC4CC4

InChI

InChI=1S/C20H26N6O3/c1-28-7-8-29-19-24-17(21)16-18(25-19)26(20(27)23-16)12-15-4-2-3-14(9-15)11-22-10-13-5-6-13/h2-4,9,13,22H,5-8,10-12H2,1H3,(H,23,27)(H2,21,24,25)