1-[5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]-3-phenyl-propan-2-one

Systemtic Name: 1-[5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]-3-phenyl-propan-2-one Openeye Name: 1-[5-[6-(cyclopropylmethylamino)purin-9-yl]tetrahydrofuran-2-yl]-3-phenyl-propan-2-one CAS Name: 1-[5-[6-(cyclopropylmethylamino)-9-purinyl]-2-oxolanyl]-3-phenyl-2-propanone IUPAC Name: 1-[5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]-3-phenylpropan-2-one Traditional Name: 1-[5-[6-(cyclopropylmethylamino)purin-9-yl]tetrahydrofuran-2-yl]-3-phenyl-acetone Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC2=NC=NC3=C2N=CN3C4CCC(O4)CC(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CC1CNC2=NC=NC3=C2N=CN3C4CCC(O4)CC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C22H25N5O2/c28-17(10-15-4-2-1-3-5-15)11-18-8-9-19(29-18)27-14-26-20-21(23-12-16-6-7-16)24-13-25-22(20)27/h1-5,13-14,16,18-19H,6-12H2,(H,23,24,25)