N-[9-[(1-phenylmethoxy-3-propan-2-yloxy-propoxy)methyl]purin-2-yl]ethanamide

Systemtic Name: N-[9-[(1-phenylmethoxy-3-propan-2-yloxy-propoxy)methyl]purin-2-yl]ethanamide Openeye Name: N-[9-[(1-benzyloxy-3-isopropoxy-propoxy)methyl]purin-2-yl]acetamide CAS Name: N-[9-[(1-phenylmethoxy-3-propan-2-yloxypropoxy)methyl]-2-purinyl]acetamide IUPAC Name: N-[9-[(1-phenylmethoxy-3-propan-2-yloxypropoxy)methyl]purin-2-yl]acetamide Traditional Name: N-[9-[(1-benzoxy-3-isopropoxy-propoxy)methyl]purin-2-yl]acetamide Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCC(OCC1=CC=CC=C1)OCN2C=NC3=CN=C(N=C32)NC(=O)C

Isomeric SMILES

CC(C)OCCC(OCC1=CC=CC=C1)OCN2C=NC3=CN=C(N=C32)NC(=O)C

InChI

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