2-[1-(6-aminopurin-9-yl)-2-oxidanyl-ethoxy]-3-ethylsulfanyl-propan-1-ol

Systemtic Name: 2-[1-(6-aminopurin-9-yl)-2-oxidanyl-ethoxy]-3-ethylsulfanyl-propan-1-ol Openeye Name: 2-[1-(6-aminopurin-9-yl)-2-hydroxy-ethoxy]-3-ethylsulfanyl-propan-1-ol CAS Name: 2-[1-(6-aminopurin-9-yl)-2-hydroxyethoxy]-3-(ethylthio)-1-propanol IUPAC Name: 2-[1-(6-aminopurin-9-yl)-2-hydroxyethoxy]-3-ethylsulfanylpropan-1-ol Traditional Name: 2-(1-adenin-9-yl-2-hydroxy-ethoxy)-3-(ethylthio)propan-1-ol Formula: C12H19N5O3S MolecularWeight: 313.37596

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC(CO)OC(CO)N1C=NC2=C1N=CN=C2N

Isomeric SMILES

CCSCC(CO)OC(CO)N1C=NC2=C1N=CN=C2N

InChI

InChI=1S/C12H19N5O3S/c1-2-21-5-8(3-18)20-9(4-19)17-7-16-10-11(13)14-6-15-12(10)17/h6-9,18-19H,2-5H2,1H3,(H2,13,14,15)