N-[9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-methylsulfanyl-purin-6-yl]methanamide

Systemtic Name: N-[9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-methylsulfanyl-purin-6-yl]methanamide Openeye Name: N-[9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-methylsulfanyl-purin-6-yl]formamide CAS Name: N-[9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-(methylthio)-6-purinyl]formamide IUPAC Name: N-[9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanylpurin-6-yl]formamide Traditional Name: N-[9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-2-(methylthio)purin-6-yl]formamide Formula: C12H15N5O5S MolecularWeight: 341.343

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C(=N1)NC=O)N=CN2C3C(C(C(O3)CO)O)O

Isomeric SMILES

CSC1=NC2=C(C(=N1)NC=O)N=CN2C3C(C(C(O3)CO)O)O

InChI

InChI=1S/C12H15N5O5S/c1-23-12-15-9(14-4-19)6-10(16-12)17(3-13-6)11-8(21)7(20)5(2-18)22-11/h3-5,7-8,11,18,20-21H,2H2,1H3,(H,14,15,16,19)