2-[6-(ethylamino)purin-9-yl]-5-[(2-phenylpropylamino)oxymethyl]oxolane-3,4-diol

Systemtic Name: 2-[6-(ethylamino)purin-9-yl]-5-[(2-phenylpropylamino)oxymethyl]oxolane-3,4-diol Openeye Name: 2-[6-(ethylamino)purin-9-yl]-5-[(2-phenylpropylamino)oxymethyl]tetrahydrofuran-3,4-diol CAS Name: 2-[6-(ethylamino)-9-purinyl]-5-[(2-phenylpropylamino)oxymethyl]oxolane-3,4-diol IUPAC Name: 2-[6-(ethylamino)purin-9-yl]-5-[(2-phenylpropylamino)oxymethyl]oxolane-3,4-diol Traditional Name: 2-[6-(ethylamino)purin-9-yl]-5-[(2-phenylpropylamino)oxymethyl]tetrahydrofuran-3,4-diol Formula: C21H28N6O4 MolecularWeight: 428.48482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=NC2=C1N=CN2C3C(C(C(O3)CONCC(C)C4=CC=CC=C4)O)O

Isomeric SMILES

CCNC1=NC=NC2=C1N=CN2C3C(C(C(O3)CONCC(C)C4=CC=CC=C4)O)O

InChI

InChI=1S/C21H28N6O4/c1-3-22-19-16-20(24-11-23-19)27(12-25-16)21-18(29)17(28)15(31-21)10-30-26-9-13(2)14-7-5-4-6-8-14/h4-8,11-13,15,17-18,21,26,28-29H,3,9-10H2,1-2H3,(H,22,23,24)