2-[6-(3,3-diphenylpropylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-(3,3-diphenylpropylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-(3,3-diphenylpropylamino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-(3,3-diphenylpropylamino)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-(3,3-diphenylpropylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-(3,3-diphenylpropylamino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C25H27N5O4 MolecularWeight: 461.51298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)C5=CC=CC=C5

InChI

InChI=1S/C25H27N5O4/c31-13-19-21(32)22(33)25(34-19)30-15-29-20-23(27-14-28-24(20)30)26-12-11-18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,14-15,18-19,21-22,25,31-33H,11-13H2,(H,26,27,28)