6-chloranyl-7-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]purine-2-carboxamide

Systemtic Name: 6-chloranyl-7-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]purine-2-carboxamide Openeye Name: 6-chloro-7-[[2-isopropoxy-1-(isopropoxymethyl)ethoxy]methyl]purine-2-carboxamide CAS Name: 6-chloro-7-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]-2-purinecarboxamide IUPAC Name: 6-chloro-7-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]purine-2-carboxamide Traditional Name: 6-chloro-7-[[2-isopropoxy-1-(isopropoxymethyl)ethoxy]methyl]purine-2-carboxamide Formula: C16H24ClN5O4 MolecularWeight: 385.84586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(COC(C)C)OCN1C=NC2=C1C(=NC(=N2)C(=O)N)Cl

Isomeric SMILES

CC(C)OCC(COC(C)C)OCN1C=NC2=C1C(=NC(=N2)C(=O)N)Cl

InChI

InChI=1S/C16H24ClN5O4/c1-9(2)24-5-11(6-25-10(3)4)26-8-22-7-19-15-12(22)13(17)20-16(21-15)14(18)23/h7,9-11H,5-6,8H2,1-4H3,(H2,18,23)