5-(2-azanyl-6-prop-2-enylsulfanyl-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: 5-(2-azanyl-6-prop-2-enylsulfanyl-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 5-(6-allylsulfanyl-2-amino-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 5-[2-amino-6-(prop-2-enylthio)-9-purinyl]-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 5-(2-amino-6-prop-2-enylsulfanylpurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-[6-(allylthio)-2-amino-purin-9-yl]-2-methylol-tetrahydrofuran-3-ol Formula: C13H17N5O3S MolecularWeight: 323.37078

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC(=NC2=C1N=CN2C3CC(C(O3)CO)O)N

Isomeric SMILES

C=CCSC1=NC(=NC2=C1N=CN2C3CC(C(O3)CO)O)N

InChI

InChI=1S/C13H17N5O3S/c1-2-3-22-12-10-11(16-13(14)17-12)18(6-15-10)9-4-7(20)8(5-19)21-9/h2,6-9,19-20H,1,3-5H2,(H2,14,16,17)