(2R,3S,4R,5R)-2-(hydroxymethyl)-5-[2-[4-(hydroxymethyl)pyrazol-1-yl]-6-(quinazolin-2-ylamino)purin-9-yl]oxolane-3,4-diol

Systemtic Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[2-[4-(hydroxymethyl)pyrazol-1-yl]-6-(quinazolin-2-ylamino)purin-9-yl]oxolane-3,4-diol Openeye Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[2-[4-(hydroxymethyl)pyrazol-1-yl]-6-(quinazolin-2-ylamino)purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[2-[4-(hydroxymethyl)-1-pyrazolyl]-6-(2-quinazolinylamino)-9-purinyl]oxolane-3,4-diol IUPAC Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[2-[4-(hydroxymethyl)pyrazol-1-yl]-6-(quinazolin-2-ylamino)purin-9-yl]oxolane-3,4-diol Traditional Name: (2R,3S,4R,5R)-2-methylol-5-[2-(4-methylolpyrazol-1-yl)-6-(quinazolin-2-ylamino)purin-9-yl]tetrahydrofuran-3,4-diol Formula: C22H21N9O5 MolecularWeight: 491.45944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC(=N2)NC3=NC(=NC4=C3N=CN4C5C(C(C(O5)CO)O)O)N6C=C(C=N6)CO

Isomeric SMILES

C1=CC=C2C(=C1)C=NC(=N2)NC3=NC(=NC4=C3N=CN4[C@H]5[C@@H]([C@@H]([C@H](O5)CO)O)O)N6C=C(C=N6)CO

InChI

InChI=1S/C22H21N9O5/c32-8-11-5-25-31(7-11)22-28-18(27-21-23-6-12-3-1-2-4-13(12)26-21)15-19(29-22)30(10-24-15)20-17(35)16(34)14(9-33)36-20/h1-7,10,14,16-17,20,32-35H,8-9H2,(H,23,26,27,28,29)/t14-,16-,17-,20-/m1/s1