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

Systemtic Name: N-[(2R,3R,4S,5R)-2-[6-(cyclohexylamino)purin-9-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-3-ethoxy-benzamide Openeye Name: N-[(2R,3R,4S,5R)-2-[6-(cyclohexylamino)purin-9-yl]-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]-3-ethoxy-benzamide CAS Name: N-[(2R,3R,4S,5R)-2-[6-(cyclohexylamino)-9-purinyl]-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl]-3-ethoxybenzamide IUPAC Name: N-[(2R,3R,4S,5R)-2-[6-(cyclohexylamino)purin-9-yl]-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-3-ethoxybenzamide Traditional Name: N-[(2R,3R,4S,5R)-2-[6-(cyclohexylamino)purin-9-yl]-4-hydroxy-5-methylol-tetrahydrofuran-3-yl]-3-ethoxy-benzamide Formula: C25H32N6O5 MolecularWeight: 496.55878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)NC2C(C(OC2N3C=NC4=C3N=CN=C4NC5CCCCC5)CO)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)N[C@@H]2[C@@H]([C@H](O[C@H]2N3C=NC4=C3N=CN=C4NC5CCCCC5)CO)O

InChI

InChI=1S/C25H32N6O5/c1-2-35-17-10-6-7-15(11-17)24(34)30-19-21(33)18(12-32)36-25(19)31-14-28-20-22(26-13-27-23(20)31)29-16-8-4-3-5-9-16/h6-7,10-11,13-14,16,18-19,21,25,32-33H,2-5,8-9,12H2,1H3,(H,30,34)(H,26,27,29)/t18-,19-,21-,25-/m1/s1