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

Systemtic Name: ethyl 5-(carbamimidoylsulfanylmethyl)-3-(2-methylpropyl)-2-oxidanylidene-oxolane-3-carboxylate hydrobromide Openeye Name: ethyl 5-(carbamimidoylsulfanylmethyl)-3-isobutyl-2-oxo-tetrahydrofuran-3-carboxylate hydrobromide CAS Name: 5-[(carbamimidoylthio)methyl]-3-(2-methylpropyl)-2-oxo-3-oxolanecarboxylic acid ethyl ester hydrobromide IUPAC Name: ethyl 5-(carbamimidoylsulfanylmethyl)-3-(2-methylpropyl)-2-oxooxolane-3-carboxylate hydrobromide Traditional Name: 5-[(amidinothio)methyl]-3-isobutyl-2-keto-tetrahydrofuran-3-carboxylic acid ethyl ester hydrobromide Formula: C13H23BrN2O4S MolecularWeight: 383.30172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(OC1=O)CSC(=N)N)CC(C)C.Br

Isomeric SMILES

CCOC(=O)C1(CC(OC1=O)CSC(=N)N)CC(C)C.Br

InChI

InChI=1S/C13H22N2O4S.BrH/c1-4-18-10(16)13(5-8(2)3)6-9(19-11(13)17)7-20-12(14)15;/h8-9H,4-7H2,1-3H3,(H3,14,15);1H