2-[6-azanyl-2-(2-pyridin-2-ylpropylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-(2-pyridin-2-ylpropylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-[2-(2-pyridyl)propylamino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[2-(2-pyridinyl)propylamino]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-(2-pyridin-2-ylpropylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-[2-(2-pyridyl)propylamino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C18H23N7O4 MolecularWeight: 401.41972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O)C4=CC=CC=N4

Isomeric SMILES

CC(CNC1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O)C4=CC=CC=N4

InChI

InChI=1S/C18H23N7O4/c1-9(10-4-2-3-5-20-10)6-21-18-23-15(19)12-16(24-18)25(8-22-12)17-14(28)13(27)11(7-26)29-17/h2-5,8-9,11,13-14,17,26-28H,6-7H2,1H3,(H3,19,21,23,24)