N-[7-[(2-phenylmethoxy-3-propan-2-yloxy-propoxy)methyl]purin-2-yl]ethanamide

Systemtic Name: N-[7-[(2-phenylmethoxy-3-propan-2-yloxy-propoxy)methyl]purin-2-yl]ethanamide Openeye Name: N-[7-[(2-benzyloxy-3-isopropoxy-propoxy)methyl]purin-2-yl]acetamide CAS Name: N-[7-[(2-phenylmethoxy-3-propan-2-yloxypropoxy)methyl]-2-purinyl]acetamide IUPAC Name: N-[7-[(2-phenylmethoxy-3-propan-2-yloxypropoxy)methyl]purin-2-yl]acetamide Traditional Name: N-[7-[(2-benzoxy-3-isopropoxy-propoxy)methyl]purin-2-yl]acetamide Formula: C21H27N5O4 MolecularWeight: 413.47018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(COCN1C=NC2=NC(=NC=C21)NC(=O)C)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)OCC(COCN1C=NC2=NC(=NC=C21)NC(=O)C)OCC3=CC=CC=C3

InChI

InChI=1S/C21H27N5O4/c1-15(2)29-12-18(30-10-17-7-5-4-6-8-17)11-28-14-26-13-23-20-19(26)9-22-21(25-20)24-16(3)27/h4-9,13,15,18H,10-12,14H2,1-3H3,(H,22,24,25,27)