N-[9-[(3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]-N-phenethyl-benzamide

Systemtic Name: N-[9-[(3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]-N-phenethyl-benzamide Openeye Name: N-[9-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]-N-phenethyl-benzamide CAS Name: N-[9-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]-N-phenethylbenzamide IUPAC Name: N-[9-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]-N-phenethylbenzamide Traditional Name: N-[9-[(3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]purin-6-yl]-N-phenethyl-benzamide Formula: C25H25N5O5 MolecularWeight: 475.4965

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(C2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCN(C2=NC=NC3=C2N=CN3C4[C@@H]([C@@H]([C@H](O4)CO)O)O)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H25N5O5/c31-13-18-20(32)21(33)25(35-18)30-15-28-19-22(26-14-27-23(19)30)29(12-11-16-7-3-1-4-8-16)24(34)17-9-5-2-6-10-17/h1-10,14-15,18,20-21,25,31-33H,11-13H2/t18-,20-,21-,25?/m1/s1