diethyl 2-methyl-5-(2-quinolin-2-ylsulfanylbutanoylamino)furan-3,4-dicarboxylate

Systemtic Name: diethyl 2-methyl-5-(2-quinolin-2-ylsulfanylbutanoylamino)furan-3,4-dicarboxylate Openeye Name: diethyl 2-methyl-5-[2-(2-quinolylsulfanyl)butanoylamino]furan-3,4-dicarboxylate CAS Name: 2-methyl-5-[[1-oxo-2-(2-quinolinylthio)butyl]amino]furan-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methyl-5-(2-quinolin-2-ylsulfanylbutanoylamino)furan-3,4-dicarboxylate Traditional Name: 2-methyl-5-[2-(2-quinolylthio)butanoylamino]furan-3,4-dicarboxylic acid diethyl ester Formula: C24H26N2O6S MolecularWeight: 470.53804

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(O1)C)C(=O)OCC)C(=O)OCC)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(O1)C)C(=O)OCC)C(=O)OCC)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H26N2O6S/c1-5-17(33-18-13-12-15-10-8-9-11-16(15)25-18)21(27)26-22-20(24(29)31-7-3)19(14(4)32-22)23(28)30-6-2/h8-13,17H,5-7H2,1-4H3,(H,26,27)