diethyl 3-(3,4-dihydro-2H-pyrrol-5-ylsulfanylmethyl)-2-ethyl-5-oxidanylidene-furan-2,4-dicarboxylate hydrobromide

Systemtic Name: diethyl 3-(3,4-dihydro-2H-pyrrol-5-ylsulfanylmethyl)-2-ethyl-5-oxidanylidene-furan-2,4-dicarboxylate hydrobromide Openeye Name: diethyl 3-(3,4-dihydro-2H-pyrrol-5-ylsulfanylmethyl)-2-ethyl-5-oxo-furan-2,4-dicarboxylate hydrobromide CAS Name: 3-[(3,4-dihydro-2H-pyrrol-5-ylthio)methyl]-2-ethyl-5-oxofuran-2,4-dicarboxylic acid diethyl ester hydrobromide IUPAC Name: diethyl 3-(3,4-dihydro-2H-pyrrol-5-ylsulfanylmethyl)-2-ethyl-5-oxofuran-2,4-dicarboxylate hydrobromide Traditional Name: 2-ethyl-5-keto-3-[(1-pyrrolin-2-ylthio)methyl]furan-2,4-dicarboxylic acid diethyl ester hydrobromide Formula: C17H24BrNO6S MolecularWeight: 450.34456

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=C(C(=O)O1)C(=O)OCC)CSC2=NCCC2)C(=O)OCC.Br

Isomeric SMILES

CCC1(C(=C(C(=O)O1)C(=O)OCC)CSC2=NCCC2)C(=O)OCC.Br

InChI

InChI=1S/C17H23NO6S.BrH/c1-4-17(16(21)23-6-3)11(10-25-12-8-7-9-18-12)13(15(20)24-17)14(19)22-5-2;/h4-10H2,1-3H3;1H