7-tert-butyl-4-ethyl-2-(hydroxymethyl)-6H-[1,2,4]triazolo[5,1-b]purin-5-one

Systemtic Name: 7-tert-butyl-4-ethyl-2-(hydroxymethyl)-6H-[1,2,4]triazolo[5,1-b]purin-5-one Openeye Name: 7-tert-butyl-4-ethyl-2-(hydroxymethyl)-6H-[1,2,4]triazolo[5,1-b]purin-5-one CAS Name: 7-tert-butyl-4-ethyl-2-(hydroxymethyl)-6H-[1,2,4]triazolo[5,1-b]purin-5-one IUPAC Name: 7-tert-butyl-4-ethyl-2-(hydroxymethyl)-6H-[1,2,4]triazolo[5,1-b]purin-5-one Traditional Name: 7-tert-butyl-4-ethyl-2-methylol-6H-[1,2,4]triazolo[5,1-b]purin-5-one Formula: C13H18N6O2 MolecularWeight: 290.32102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C(N2)C(C)(C)C)N3C1=NC(=N3)CO

Isomeric SMILES

CCN1C(=O)C2=C(N=C(N2)C(C)(C)C)N3C1=NC(=N3)CO

InChI

InChI=1S/C13H18N6O2/c1-5-18-10(21)8-9(16-11(15-8)13(2,3)4)19-12(18)14-7(6-20)17-19/h20H,5-6H2,1-4H3,(H,15,16)