2-[6-azanyl-2-(phenethylamino)purin-9-yl]-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-(phenethylamino)purin-9-yl]-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-(phenethylamino)purin-9-yl]-5-(3-methyl-1,2,4-oxadiazol-5-yl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-(phenethylamino)-9-purinyl]-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-(phenethylamino)purin-9-yl]-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-(phenethylamino)purin-9-yl]-5-(3-methyl-1,2,4-oxadiazol-5-yl)tetrahydrofuran-3,4-diol Formula: C20H22N8O4 MolecularWeight: 438.43988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2C(C(C(O2)N3C=NC4=C3N=C(N=C4N)NCCC5=CC=CC=C5)O)O

Isomeric SMILES

CC1=NOC(=N1)C2C(C(C(O2)N3C=NC4=C3N=C(N=C4N)NCCC5=CC=CC=C5)O)O

InChI

InChI=1S/C20H22N8O4/c1-10-24-18(32-27-10)15-13(29)14(30)19(31-15)28-9-23-12-16(21)25-20(26-17(12)28)22-8-7-11-5-3-2-4-6-11/h2-6,9,13-15,19,29-30H,7-8H2,1H3,(H3,21,22,25,26)