6-(6-aminopurin-9-yl)-6-ethylsulfanyl-hexane-1,2,3,4,5-pentol

Systemtic Name: 6-(6-aminopurin-9-yl)-6-ethylsulfanyl-hexane-1,2,3,4,5-pentol Openeye Name: 6-(6-aminopurin-9-yl)-6-ethylsulfanyl-hexane-1,2,3,4,5-pentol CAS Name: 6-(6-aminopurin-9-yl)-6-(ethylthio)hexane-1,2,3,4,5-pentol IUPAC Name: 6-(6-aminopurin-9-yl)-6-ethylsulfanylhexane-1,2,3,4,5-pentol Traditional Name: 6-adenin-9-yl-6-(ethylthio)hexane-1,2,3,4,5-pentol Formula: C13H21N5O5S MolecularWeight: 359.40134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(C(C(C(C(CO)O)O)O)O)N1C=NC2=C1N=CN=C2N

Isomeric SMILES

CCSC(C(C(C(C(CO)O)O)O)O)N1C=NC2=C1N=CN=C2N

InChI

InChI=1S/C13H21N5O5S/c1-2-24-13(10(23)9(22)8(21)6(20)3-19)18-5-17-7-11(14)15-4-16-12(7)18/h4-6,8-10,13,19-23H,2-3H2,1H3,(H2,14,15,16)