5-[2,6-bis(azanyl)purin-9-yl]-2-(hydroxymethyl)oxolane-2-carbonitrile

Systemtic Name: 5-[2,6-bis(azanyl)purin-9-yl]-2-(hydroxymethyl)oxolane-2-carbonitrile Openeye Name: 5-(2,6-diaminopurin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-2-carbonitrile CAS Name: 5-(2,6-diamino-9-purinyl)-2-(hydroxymethyl)-2-oxolanecarbonitrile IUPAC Name: 5-(2,6-diaminopurin-9-yl)-2-(hydroxymethyl)oxolane-2-carbonitrile Traditional Name: 5-(2,6-diaminopurin-9-yl)-2-methylol-tetrahydrofuran-2-carbonitrile Formula: C11H13N7O2 MolecularWeight: 275.26662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1N2C=NC3=C2N=C(N=C3N)N)(CO)C#N

Isomeric SMILES

C1CC(OC1N2C=NC3=C2N=C(N=C3N)N)(CO)C#N

InChI

InChI=1S/C11H13N7O2/c12-3-11(4-19)2-1-6(20-11)18-5-15-7-8(13)16-10(14)17-9(7)18/h5-6,19H,1-2,4H2,(H4,13,14,16,17)