(4,5-diacetyloxy-6-carbamimidoylsulfanyl-oxan-3-yl) ethanoate hydrobromide

Systemtic Name: (4,5-diacetyloxy-6-carbamimidoylsulfanyl-oxan-3-yl) ethanoate hydrobromide Openeye Name: (4,5-diacetoxy-6-carbamimidoylsulfanyl-tetrahydropyran-3-yl) acetate hydrobromide CAS Name: acetic acid [4,5-diacetyloxy-6-(carbamimidoylthio)-3-oxanyl] ester hydrobromide IUPAC Name: (4,5-diacetyloxy-6-carbamimidoylsulfanyloxan-3-yl) acetate hydrobromide Traditional Name: acetic acid [4,5-diacetoxy-6-(amidinothio)tetrahydropyran-3-yl] ester hydrobromide Formula: C12H19BrN2O7S MolecularWeight: 415.25746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)SC(=N)N.Br

Isomeric SMILES

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)SC(=N)N.Br

InChI

InChI=1S/C12H18N2O7S.BrH/c1-5(15)19-8-4-18-11(22-12(13)14)10(21-7(3)17)9(8)20-6(2)16;/h8-11H,4H2,1-3H3,(H3,13,14);1H