2-(6-aminopurin-9-yl)-3-ethyl-4-methyl-2H-furan-5-one

Systemtic Name: 2-(6-aminopurin-9-yl)-3-ethyl-4-methyl-2H-furan-5-one Openeye Name: 2-(6-aminopurin-9-yl)-3-ethyl-4-methyl-2H-furan-5-one CAS Name: 2-(6-aminopurin-9-yl)-3-ethyl-4-methyl-2H-furan-5-one IUPAC Name: 2-(6-aminopurin-9-yl)-3-ethyl-4-methyl-2H-furan-5-one Traditional Name: 2-adenin-9-yl-3-ethyl-4-methyl-2H-furan-5-one Formula: C12H13N5O2 MolecularWeight: 259.26392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)OC1N2C=NC3=C2N=CN=C3N)C

Isomeric SMILES

CCC1=C(C(=O)OC1N2C=NC3=C2N=CN=C3N)C

InChI

InChI=1S/C12H13N5O2/c1-3-7-6(2)12(18)19-11(7)17-5-16-8-9(13)14-4-15-10(8)17/h4-5,11H,3H2,1-2H3,(H2,13,14,15)