2-[6-azanyl-8-(4-azidobutylamino)purin-9-yl]-5-(aziridin-1-ylmethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-8-(4-azidobutylamino)purin-9-yl]-5-(aziridin-1-ylmethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-8-(4-azidobutylamino)purin-9-yl]-5-(aziridin-1-ylmethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-8-(4-azidobutylamino)-9-purinyl]-5-(1-aziridinylmethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-8-(4-azidobutylamino)purin-9-yl]-5-(aziridin-1-ylmethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-8-(4-azidobutylamino)purin-9-yl]-5-(ethyleniminomethyl)tetrahydrofuran-3,4-diol Formula: C16H24N10O3 MolecularWeight: 404.42696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1CC2C(C(C(O2)N3C4=C(C(=NC=N4)N)N=C3NCCCCN=[N+]=[N-])O)O

Isomeric SMILES

C1CN1CC2C(C(C(O2)N3C4=C(C(=NC=N4)N)N=C3NCCCCN=[N+]=[N-])O)O

InChI

InChI=1S/C16H24N10O3/c17-13-10-14(21-8-20-13)26(16(23-10)19-3-1-2-4-22-24-18)15-12(28)11(27)9(29-15)7-25-5-6-25/h8-9,11-12,15,27-28H,1-7H2,(H,19,23)(H2,17,20,21)