ethyl 5-(carbamimidoylsulfanylmethyl)-3-ethyl-2-oxidanylidene-oxolane-3-carboxylate hydrobromide

Systemtic Name: ethyl 5-(carbamimidoylsulfanylmethyl)-3-ethyl-2-oxidanylidene-oxolane-3-carboxylate hydrobromide Openeye Name: ethyl 5-(carbamimidoylsulfanylmethyl)-3-ethyl-2-oxo-tetrahydrofuran-3-carboxylate hydrobromide CAS Name: 5-[(carbamimidoylthio)methyl]-3-ethyl-2-oxo-3-oxolanecarboxylic acid ethyl ester hydrobromide IUPAC Name: ethyl 5-(carbamimidoylsulfanylmethyl)-3-ethyl-2-oxooxolane-3-carboxylate hydrobromide Traditional Name: 5-[(amidinothio)methyl]-3-ethyl-2-keto-tetrahydrofuran-3-carboxylic acid ethyl ester hydrobromide Formula: C11H19BrN2O4S MolecularWeight: 355.24856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(OC1=O)CSC(=N)N)C(=O)OCC.Br

Isomeric SMILES

CCC1(CC(OC1=O)CSC(=N)N)C(=O)OCC.Br

InChI

InChI=1S/C11H18N2O4S.BrH/c1-3-11(8(14)16-4-2)5-7(17-9(11)15)6-18-10(12)13;/h7H,3-6H2,1-2H3,(H3,12,13);1H