5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)oxolane-2-carbonitrile

Systemtic Name: 5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)oxolane-2-carbonitrile Openeye Name: 5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-2-carbonitrile CAS Name: 5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)-2-oxolanecarbonitrile IUPAC Name: 5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)oxolane-2-carbonitrile Traditional Name: 5-(2-amino-6-keto-3H-purin-9-yl)-2-methylol-tetrahydrofuran-2-carbonitrile Formula: C11H12N6O3 MolecularWeight: 276.25138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1N2C=NC3=C2NC(=NC3=O)N)(CO)C#N

Isomeric SMILES

C1CC(OC1N2C=NC3=C2NC(=NC3=O)N)(CO)C#N

InChI

InChI=1S/C11H12N6O3/c12-3-11(4-18)2-1-6(20-11)17-5-14-7-8(17)15-10(13)16-9(7)19/h5-6,18H,1-2,4H2,(H3,13,15,16,19)