N-[6-chloranyl-7-(2-propan-2-yloxyethoxymethyl)purin-2-yl]ethanamide

Systemtic Name: N-[6-chloranyl-7-(2-propan-2-yloxyethoxymethyl)purin-2-yl]ethanamide Openeye Name: N-[6-chloro-7-(2-isopropoxyethoxymethyl)purin-2-yl]acetamide CAS Name: N-[6-chloro-7-(2-propan-2-yloxyethoxymethyl)-2-purinyl]acetamide IUPAC Name: N-[6-chloro-7-(2-propan-2-yloxyethoxymethyl)purin-2-yl]acetamide Traditional Name: N-[6-chloro-7-(2-isopropoxyethoxymethyl)purin-2-yl]acetamide Formula: C13H18ClN5O3 MolecularWeight: 327.76672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCOCN1C=NC2=C1C(=NC(=N2)NC(=O)C)Cl

Isomeric SMILES

CC(C)OCCOCN1C=NC2=C1C(=NC(=N2)NC(=O)C)Cl

InChI

InChI=1S/C13H18ClN5O3/c1-8(2)22-5-4-21-7-19-6-15-12-10(19)11(14)17-13(18-12)16-9(3)20/h6,8H,4-5,7H2,1-3H3,(H,16,17,18,20)