9-[4-ethylsulfanyl-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 9-[4-ethylsulfanyl-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[4-ethylsulfanyl-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 9-[4-(ethylthio)-3-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 9-[4-ethylsulfanyl-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[4-(ethylthio)-3-hydroxy-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C(OC(C1O)N2C=NC3=C2NC=NC3=O)CO

Isomeric SMILES

CCSC1C(OC(C1O)N2C=NC3=C2NC=NC3=O)CO

InChI

InChI=1S/C12H16N4O4S/c1-2-21-9-6(3-17)20-12(8(9)18)16-5-15-7-10(16)13-4-14-11(7)19/h4-6,8-9,12,17-18H,2-3H2,1H3,(H,13,14,19)