[4,5,6-triacetyloxy-2-(carbamimidoylsulfanylmethyl)oxan-3-yl] ethanoate hydroiodide

Systemtic Name: [4,5,6-triacetyloxy-2-(carbamimidoylsulfanylmethyl)oxan-3-yl] ethanoate hydroiodide Openeye Name: [4,5,6-triacetoxy-2-(carbamimidoylsulfanylmethyl)tetrahydropyran-3-yl] acetate hydroiodide CAS Name: acetic acid [4,5,6-triacetyloxy-2-[(carbamimidoylthio)methyl]-3-oxanyl] ester hydroiodide IUPAC Name: [4,5,6-triacetyloxy-2-(carbamimidoylsulfanylmethyl)oxan-3-yl] acetate hydroiodide Traditional Name: acetic acid [4,5,6-triacetoxy-2-[(amidinothio)methyl]tetrahydropyran-3-yl] ester hydroiodide Formula: C15H23IN2O9S MolecularWeight: 534.32059

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)OC(=O)C)CSC(=N)N.I

Isomeric SMILES

CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)OC(=O)C)CSC(=N)N.I

InChI

InChI=1S/C15H22N2O9S.HI/c1-6(18)22-11-10(5-27-15(16)17)26-14(25-9(4)21)13(24-8(3)20)12(11)23-7(2)19;/h10-14H,5H2,1-4H3,(H3,16,17);1H