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

Systemtic Name: ethyl 5-(carbamimidoylsulfanylmethyl)-2-oxidanylidene-3-propyl-oxolane-3-carboxylate hydrobromide Openeye Name: ethyl 5-(carbamimidoylsulfanylmethyl)-2-oxo-3-propyl-tetrahydrofuran-3-carboxylate hydrobromide CAS Name: 5-[(carbamimidoylthio)methyl]-2-oxo-3-propyl-3-oxolanecarboxylic acid ethyl ester hydrobromide IUPAC Name: ethyl 5-(carbamimidoylsulfanylmethyl)-2-oxo-3-propyloxolane-3-carboxylate hydrobromide Traditional Name: 5-[(amidinothio)methyl]-2-keto-3-propyl-tetrahydrofuran-3-carboxylic acid ethyl ester hydrobromide Formula: C12H21BrN2O4S MolecularWeight: 369.27514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(OC1=O)CSC(=N)N)C(=O)OCC.Br

Isomeric SMILES

CCCC1(CC(OC1=O)CSC(=N)N)C(=O)OCC.Br

InChI

InChI=1S/C12H20N2O4S.BrH/c1-3-5-12(9(15)17-4-2)6-8(18-10(12)16)7-19-11(13)14;/h8H,3-7H2,1-2H3,(H3,13,14);1H