2-(heptan-2-ylamino)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-purin-9-yl-oxolane-3,4-diol

Systemtic Name: 2-(heptan-2-ylamino)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-purin-9-yl-oxolane-3,4-diol Openeye Name: 2-(1-methylhexylamino)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-purin-9-yl-tetrahydrofuran-3,4-diol CAS Name: 2-(heptan-2-ylamino)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(9-purinyl)oxolane-3,4-diol IUPAC Name: 2-(heptan-2-ylamino)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-purin-9-yloxolane-3,4-diol Traditional Name: 2-(1-methylhexylamino)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-purin-9-yl-tetrahydrofuran-3,4-diol Formula: C19H27N7O4 MolecularWeight: 417.46218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1(C(C(C(O1)C2=NC(=NO2)C)O)O)N3C=NC4=CN=CN=C43

Isomeric SMILES

CCCCCC(C)NC1(C(C(C(O1)C2=NC(=NO2)C)O)O)N3C=NC4=CN=CN=C43

InChI

InChI=1S/C19H27N7O4/c1-4-5-6-7-11(2)24-19(26-10-22-13-8-20-9-21-17(13)26)16(28)14(27)15(29-19)18-23-12(3)25-30-18/h8-11,14-16,24,27-28H,4-7H2,1-3H3