5-[6-azanyl-9-[4-methoxy-5-(methoxymethyl)oxolan-2-yl]purin-8-yl]sulfanylpentane-1,2-diol

Systemtic Name: 5-[6-azanyl-9-[4-methoxy-5-(methoxymethyl)oxolan-2-yl]purin-8-yl]sulfanylpentane-1,2-diol Openeye Name: 5-[6-amino-9-[4-methoxy-5-(methoxymethyl)tetrahydrofuran-2-yl]purin-8-yl]sulfanylpentane-1,2-diol CAS Name: 5-[[6-amino-9-[4-methoxy-5-(methoxymethyl)-2-oxolanyl]-8-purinyl]thio]pentane-1,2-diol IUPAC Name: 5-[6-amino-9-[4-methoxy-5-(methoxymethyl)oxolan-2-yl]purin-8-yl]sulfanylpentane-1,2-diol Traditional Name: 5-[[6-amino-9-[4-methoxy-5-(methoxymethyl)tetrahydrofuran-2-yl]purin-8-yl]thio]pentane-1,2-diol Formula: C17H27N5O5S MolecularWeight: 413.49178

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Descriptors Computed from Structure

Canonical SMILES:

COCC1C(CC(O1)N2C3=C(C(=NC=N3)N)N=C2SCCCC(CO)O)OC

Isomeric SMILES

COCC1C(CC(O1)N2C3=C(C(=NC=N3)N)N=C2SCCCC(CO)O)OC

InChI

InChI=1S/C17H27N5O5S/c1-25-8-12-11(26-2)6-13(27-12)22-16-14(15(18)19-9-20-16)21-17(22)28-5-3-4-10(24)7-23/h9-13,23-24H,3-8H2,1-2H3,(H2,18,19,20)