2-[2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)-propan-2-yl-amino]purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-[2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)-propan-2-yl-amino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)-isopropyl-amino]purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-[2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)-propan-2-ylamino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-[2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)-propan-2-ylamino]purin-9-yl]oxolane-3,4-diol Traditional Name: 2-[2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)-isopropyl-amino]purin-9-yl]tetrahydrofuran-3,4-diol Formula: C18H25N7O4 MolecularWeight: 403.4356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=NC=C2C(=N1)N(C=N2)C3C(C(CO3)O)O)C4=NC(=NO4)C(C)(C)C

Isomeric SMILES

CC(C)N(C1=NC=C2C(=N1)N(C=N2)C3C(C(CO3)O)O)C4=NC(=NO4)C(C)(C)C

InChI

InChI=1S/C18H25N7O4/c1-9(2)25(17-22-15(23-29-17)18(3,4)5)16-19-6-10-13(21-16)24(8-20-10)14-12(27)11(26)7-28-14/h6,8-9,11-12,14,26-27H,7H2,1-5H3