2-[6-azanyl-2-[3-(1-oxidanylcyclopropyl)prop-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-[3-(1-oxidanylcyclopropyl)prop-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-[3-(1-hydroxycyclopropyl)prop-1-ynyl]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[3-(1-hydroxycyclopropyl)prop-1-ynyl]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-[3-(1-hydroxycyclopropyl)prop-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-[3-(1-hydroxycyclopropyl)prop-1-ynyl]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C16H19N5O5 MolecularWeight: 361.35256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1(CC#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O)O

Isomeric SMILES

C1CC1(CC#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O)O

InChI

InChI=1S/C16H19N5O5/c17-13-10-14(20-9(19-13)2-1-3-16(25)4-5-16)21(7-18-10)15-12(24)11(23)8(6-22)26-15/h7-8,11-12,15,22-25H,3-6H2,(H2,17,19,20)