2-azanyl-7-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-7-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 2-amino-7-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 2-amino-7-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile IUPAC Name: 2-amino-7-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 2-amino-7-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-4-keto-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C12H13N5O4 MolecularWeight: 291.26272

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=C(C3=C2NC(=NC3=O)N)C#N)CO)O

Isomeric SMILES

C1C(C(OC1N2C=C(C3=C2NC(=NC3=O)N)C#N)CO)O

InChI

InChI=1S/C12H13N5O4/c13-2-5-3-17(8-1-6(19)7(4-18)21-8)10-9(5)11(20)16-12(14)15-10/h3,6-8,18-19H,1,4H2,(H3,14,15,16,20)