2-(2-azanyl-4-chloranyl-5-isocyano-pyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-(2-azanyl-4-chloranyl-5-isocyano-pyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-(2-amino-4-chloro-5-isocyano-pyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(2-amino-4-chloro-5-isocyano-7-pyrrolo[2,3-d]pyrimidinyl)-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-(2-amino-4-chloro-5-isocyanopyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-(2-amino-4-chloro-5-isocyano-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methylol-tetrahydrofuran-3,4-diol Formula: C12H12ClN5O4 MolecularWeight: 325.70778

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CN(C2=C1C(=NC(=N2)N)Cl)C3C(C(C(O3)CO)O)O

Isomeric SMILES

[C-]#[N+]C1=CN(C2=C1C(=NC(=N2)N)Cl)C3C(C(C(O3)CO)O)O

InChI

InChI=1S/C12H12ClN5O4/c1-15-4-2-18(10-6(4)9(13)16-12(14)17-10)11-8(21)7(20)5(3-19)22-11/h2,5,7-8,11,19-21H,3H2,(H2,14,16,17)