2-[6-[(4-azanyl-3-iodanyl-phenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-[(4-azanyl-3-iodanyl-phenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-[(4-amino-3-iodo-phenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-[(4-amino-3-iodophenyl)methylamino]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-[(4-amino-3-iodophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-[(4-amino-3-iodo-benzyl)amino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H19IN6O4 MolecularWeight: 498.27503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)I)N

Isomeric SMILES

C1=CC(=C(C=C1CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)I)N

InChI

InChI=1S/C17H19IN6O4/c18-9-3-8(1-2-10(9)19)4-20-15-12-16(22-6-21-15)24(7-23-12)17-14(27)13(26)11(5-25)28-17/h1-3,6-7,11,13-14,17,25-27H,4-5,19H2,(H,20,21,22)