3-ethanoyl-N-[(2R,3R,4S,5R)-5-(hydroxymethyl)-2-[6-(naphthalen-1-ylmethylamino)purin-9-yl]-4-oxidanyl-oxolan-3-yl]benzamide

Systemtic Name: 3-ethanoyl-N-[(2R,3R,4S,5R)-5-(hydroxymethyl)-2-[6-(naphthalen-1-ylmethylamino)purin-9-yl]-4-oxidanyl-oxolan-3-yl]benzamide Openeye Name: 3-acetyl-N-[(2R,3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-[6-(1-naphthylmethylamino)purin-9-yl]tetrahydrofuran-3-yl]benzamide CAS Name: 3-acetyl-N-[(2R,3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-[6-(1-naphthalenylmethylamino)-9-purinyl]-3-oxolanyl]benzamide IUPAC Name: 3-acetyl-N-[(2R,3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-[6-(naphthalen-1-ylmethylamino)purin-9-yl]oxolan-3-yl]benzamide Traditional Name: 3-acetyl-N-[(2R,3R,4S,5R)-4-hydroxy-5-methylol-2-[6-(1-naphthylmethylamino)purin-9-yl]tetrahydrofuran-3-yl]benzamide Formula: C30H28N6O5 MolecularWeight: 552.58052

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)C(=O)NC2C(C(OC2N3C=NC4=C3N=CN=C4NCC5=CC=CC6=CC=CC=C65)CO)O

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)C(=O)N[C@@H]2[C@@H]([C@H](O[C@H]2N3C=NC4=C3N=CN=C4NCC5=CC=CC6=CC=CC=C65)CO)O

InChI

InChI=1S/C30H28N6O5/c1-17(38)19-8-5-9-20(12-19)29(40)35-24-26(39)23(14-37)41-30(24)36-16-34-25-27(32-15-33-28(25)36)31-13-21-10-4-7-18-6-2-3-11-22(18)21/h2-12,15-16,23-24,26,30,37,39H,13-14H2,1H3,(H,35,40)(H,31,32,33)/t23-,24-,26-,30-/m1/s1