9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-6-(methylamino)purine-2-carbonitrile

Systemtic Name: 9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-6-(methylamino)purine-2-carbonitrile Openeye Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-(methylamino)purine-2-carbonitrile CAS Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-(methylamino)-2-purinecarbonitrile IUPAC Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-(methylamino)purine-2-carbonitrile Traditional Name: 9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-6-(methylamino)purine-2-carbonitrile Formula: C12H14N6O4 MolecularWeight: 306.27736

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)C#N

Isomeric SMILES

CNC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)C#N

InChI

InChI=1S/C12H14N6O4/c1-14-10-7-11(17-6(2-13)16-10)18(4-15-7)12-9(21)8(20)5(3-19)22-12/h4-5,8-9,12,19-21H,3H2,1H3,(H,14,16,17)