2-[6-azanyl-2-[(E)-5-iodanylpent-4-enyl]sulfanyl-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-[(E)-5-iodanylpent-4-enyl]sulfanyl-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-[(E)-5-iodopent-4-enyl]sulfanyl-purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[[(E)-5-iodopent-4-enyl]thio]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-[(E)-5-iodopent-4-enyl]sulfanylpurin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-[[(E)-5-iodopent-4-enyl]thio]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C15H20IN5O4S MolecularWeight: 493.31987

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2N)SCCCC=CI

Isomeric SMILES

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2N)SCCC/C=C/I

InChI

InChI=1S/C15H20IN5O4S/c16-4-2-1-3-5-26-15-19-12(17)9-13(20-15)21(7-18-9)14-11(24)10(23)8(6-22)25-14/h2,4,7-8,10-11,14,22-24H,1,3,5-6H2,(H2,17,19,20)/b4-2+