2-[6-(oxolan-3-ylamino)purin-9-yl]-5-[(3-phenyl-1,2-oxazol-5-yl)methylsulfanylmethyl]oxolane-3,4-diol

Systemtic Name: 2-[6-(oxolan-3-ylamino)purin-9-yl]-5-[(3-phenyl-1,2-oxazol-5-yl)methylsulfanylmethyl]oxolane-3,4-diol Openeye Name: 2-[(3-phenylisoxazol-5-yl)methylsulfanylmethyl]-5-[6-(tetrahydrofuran-3-ylamino)purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-[6-(3-oxolanylamino)-9-purinyl]-5-[[(3-phenyl-5-isoxazolyl)methylthio]methyl]oxolane-3,4-diol IUPAC Name: 2-[6-(oxolan-3-ylamino)purin-9-yl]-5-[(3-phenyl-1,2-oxazol-5-yl)methylsulfanylmethyl]oxolane-3,4-diol Traditional Name: 2-[[(3-phenylisoxazol-5-yl)methylthio]methyl]-5-[6-(tetrahydrofuran-3-ylamino)purin-9-yl]tetrahydrofuran-3,4-diol Formula: C24H26N6O5S MolecularWeight: 510.56544

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1NC2=NC=NC3=C2N=CN3C4C(C(C(O4)CSCC5=CC(=NO5)C6=CC=CC=C6)O)O

Isomeric SMILES

C1COCC1NC2=NC=NC3=C2N=CN3C4C(C(C(O4)CSCC5=CC(=NO5)C6=CC=CC=C6)O)O

InChI

InChI=1S/C24H26N6O5S/c31-20-18(11-36-10-16-8-17(29-35-16)14-4-2-1-3-5-14)34-24(21(20)32)30-13-27-19-22(25-12-26-23(19)30)28-15-6-7-33-9-15/h1-5,8,12-13,15,18,20-21,24,31-32H,6-7,9-11H2,(H,25,26,28)