9-[1,3-bis[di(propan-2-yloxy)phosphorylmethoxy]propan-2-yl]-N-cyclopropyl-purin-6-amine

Systemtic Name: 9-[1,3-bis[di(propan-2-yloxy)phosphorylmethoxy]propan-2-yl]-N-cyclopropyl-purin-6-amine Openeye Name: N-cyclopropyl-9-[2-(diisopropoxyphosphorylmethoxy)-1-(diisopropoxyphosphorylmethoxymethyl)ethyl]purin-6-amine CAS Name: 9-[1,3-bis[di(propan-2-yloxy)phosphorylmethoxy]propan-2-yl]-N-cyclopropyl-6-purinamine IUPAC Name: 9-[1,3-bis[di(propan-2-yloxy)phosphorylmethoxy]propan-2-yl]-N-cyclopropylpurin-6-amine Traditional Name: cyclopropyl-[9-[2-(diisopropoxyphosphorylmethoxy)-1-(diisopropoxyphosphorylmethoxymethyl)ethyl]purin-6-yl]amine Formula: C25H45N5O8P2 MolecularWeight: 605.601022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(COCC(COCP(=O)(OC(C)C)OC(C)C)N1C=NC2=C1N=CN=C2NC3CC3)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(COCC(COCP(=O)(OC(C)C)OC(C)C)N1C=NC2=C1N=CN=C2NC3CC3)OC(C)C

InChI

InChI=1S/C25H45N5O8P2/c1-17(2)35-39(31,36-18(3)4)15-33-11-22(12-34-16-40(32,37-19(5)6)38-20(7)8)30-14-28-23-24(29-21-9-10-21)26-13-27-25(23)30/h13-14,17-22H,9-12,15-16H2,1-8H3,(H,26,27,29)