[2-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-6-oxidanylidene-7-prop-2-enyl-3H-purin-8-ylidene]cyanamide

Systemtic Name: [2-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-6-oxidanylidene-7-prop-2-enyl-3H-purin-8-ylidene]cyanamide Openeye Name: [7-allyl-2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-oxo-3H-purin-8-ylidene]cyanamide CAS Name: [2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-oxo-7-prop-2-enyl-3H-purin-8-ylidene]cyanamide IUPAC Name: [2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-oxo-7-prop-2-enyl-3H-purin-8-ylidene]cyanamide Traditional Name: [7-allyl-2-amino-9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-6-keto-3H-purin-8-ylidene]cyanamide Formula: C14H17N7O5 MolecularWeight: 363.32868

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(NC(=NC2=O)N)N(C1=NC#N)C3C(C(C(O3)CO)O)O

Isomeric SMILES

C=CCN1C2=C(NC(=NC2=O)N)N(C1=NC#N)C3C(C(C(O3)CO)O)O

InChI

InChI=1S/C14H17N7O5/c1-2-3-20-7-10(18-13(16)19-11(7)25)21(14(20)17-5-15)12-9(24)8(23)6(4-22)26-12/h2,6,8-9,12,22-24H,1,3-4H2,(H3,16,18,19,25)