N6-cyclopropyl-9-[(5-phosphonatooxolan-2-yl)methyl]purine-2,6-diamine

Systemtic Name: N6-cyclopropyl-9-[(5-phosphonatooxolan-2-yl)methyl]purine-2,6-diamine Openeye Name: N6-cyclopropyl-9-[(5-phosphonatotetrahydrofuran-2-yl)methyl]purine-2,6-diamine CAS Name: N6-cyclopropyl-9-[(5-phosphonato-2-oxolanyl)methyl]purine-2,6-diamine IUPAC Name: 6-N-cyclopropyl-9-[(5-phosphonatooxolan-2-yl)methyl]purine-2,6-diamine Traditional Name: [2-amino-9-[(5-phosphonatotetrahydrofuran-2-yl)methyl]purin-6-yl]-cyclopropyl-amine Formula: C13H17N6O4P-2 MolecularWeight: 352.285641

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=C2N=CN3CC4CCC(O4)P(=O)([O-])[O-])N

Isomeric SMILES

C1CC1NC2=NC(=NC3=C2N=CN3CC4CCC(O4)P(=O)([O-])[O-])N

InChI

InChI=1S/C13H19N6O4P/c14-13-17-11(16-7-1-2-7)10-12(18-13)19(6-15-10)5-8-3-4-9(23-8)24(20,21)22/h6-9H,1-5H2,(H2,20,21,22)(H3,14,16,17,18)/p-2