N-[5-(hydroxymethyl)-2-[6-(2-methylpropanoylamino)purin-9-yl]-4-oxidanyl-oxolan-3-yl]-3-methoxy-benzamide

Systemtic Name: N-[5-(hydroxymethyl)-2-[6-(2-methylpropanoylamino)purin-9-yl]-4-oxidanyl-oxolan-3-yl]-3-methoxy-benzamide Openeye Name: N-[4-hydroxy-5-(hydroxymethyl)-2-[6-(2-methylpropanoylamino)purin-9-yl]tetrahydrofuran-3-yl]-3-methoxy-benzamide CAS Name: N-[4-hydroxy-5-(hydroxymethyl)-2-[6-[(2-methyl-1-oxopropyl)amino]-9-purinyl]-3-oxolanyl]-3-methoxybenzamide IUPAC Name: N-[4-hydroxy-5-(hydroxymethyl)-2-[6-(2-methylpropanoylamino)purin-9-yl]oxolan-3-yl]-3-methoxybenzamide Traditional Name: N-[4-hydroxy-2-[6-(isobutyrylamino)purin-9-yl]-5-methylol-tetrahydrofuran-3-yl]-3-methoxy-benzamide Formula: C22H26N6O6 MolecularWeight: 470.47844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)O)NC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)C(=O)NC1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)O)NC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C22H26N6O6/c1-11(2)20(31)27-18-16-19(24-9-23-18)28(10-25-16)22-15(17(30)14(8-29)34-22)26-21(32)12-5-4-6-13(7-12)33-3/h4-7,9-11,14-15,17,22,29-30H,8H2,1-3H3,(H,26,32)(H,23,24,27,31)