1-[5-(6-aminopurin-9-yl)-4-ethylsulfanyl-3-oxidanyl-oxolan-2-yl]ethane-1,2-diol

Systemtic Name: 1-[5-(6-aminopurin-9-yl)-4-ethylsulfanyl-3-oxidanyl-oxolan-2-yl]ethane-1,2-diol Openeye Name: 1-[5-(6-aminopurin-9-yl)-4-ethylsulfanyl-3-hydroxy-tetrahydrofuran-2-yl]ethane-1,2-diol CAS Name: 1-[5-(6-aminopurin-9-yl)-4-(ethylthio)-3-hydroxy-2-oxolanyl]ethane-1,2-diol IUPAC Name: 1-[5-(6-aminopurin-9-yl)-4-ethylsulfanyl-3-hydroxyoxolan-2-yl]ethane-1,2-diol Traditional Name: 1-[5-adenin-9-yl-4-(ethylthio)-3-hydroxy-tetrahydrofuran-2-yl]ethane-1,2-diol Formula: C13H19N5O4S MolecularWeight: 341.38606

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C(C(OC1N2C=NC3=C2N=CN=C3N)C(CO)O)O

Isomeric SMILES

CCSC1C(C(OC1N2C=NC3=C2N=CN=C3N)C(CO)O)O

InChI

InChI=1S/C13H19N5O4S/c1-2-23-10-8(21)9(6(20)3-19)22-13(10)18-5-17-7-11(14)15-4-16-12(7)18/h4-6,8-10,13,19-21H,2-3H2,1H3,(H2,14,15,16)