2-(6-aminopurin-9-yl)-5-(pent-2-ynylsulfanylmethyl)oxolane-3,4-diol

Systemtic Name: 2-(6-aminopurin-9-yl)-5-(pent-2-ynylsulfanylmethyl)oxolane-3,4-diol Openeye Name: 2-(6-aminopurin-9-yl)-5-(pent-2-ynylsulfanylmethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(6-aminopurin-9-yl)-5-[(pent-2-ynylthio)methyl]oxolane-3,4-diol IUPAC Name: 2-(6-aminopurin-9-yl)-5-(pent-2-ynylsulfanylmethyl)oxolane-3,4-diol Traditional Name: 2-adenin-9-yl-5-[(pent-2-ynylthio)methyl]tetrahydrofuran-3,4-diol Formula: C15H19N5O3S MolecularWeight: 349.40806

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCSCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O

Isomeric SMILES

CCC#CCSCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O

InChI

InChI=1S/C15H19N5O3S/c1-2-3-4-5-24-6-9-11(21)12(22)15(23-9)20-8-19-10-13(16)17-7-18-14(10)20/h7-9,11-12,15,21-22H,2,5-6H2,1H3,(H2,16,17,18)