2-(chloromethyl)-5-[6-[(1-phenylcyclopropyl)methylamino]purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(chloromethyl)-5-[6-[(1-phenylcyclopropyl)methylamino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(chloromethyl)-5-[6-[(1-phenylcyclopropyl)methylamino]purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(chloromethyl)-5-[6-[(1-phenylcyclopropyl)methylamino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(chloromethyl)-5-[6-[(1-phenylcyclopropyl)methylamino]purin-9-yl]oxolane-3,4-diol Traditional Name: 2-(chloromethyl)-5-[6-[(1-phenylcyclopropyl)methylamino]purin-9-yl]tetrahydrofuran-3,4-diol Formula: C20H22ClN5O3 MolecularWeight: 415.87338

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CCl)O)O)C5=CC=CC=C5

Isomeric SMILES

C1CC1(CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CCl)O)O)C5=CC=CC=C5

InChI

InChI=1S/C20H22ClN5O3/c21-8-13-15(27)16(28)19(29-13)26-11-25-14-17(23-10-24-18(14)26)22-9-20(6-7-20)12-4-2-1-3-5-12/h1-5,10-11,13,15-16,19,27-28H,6-9H2,(H,22,23,24)