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

Systemtic Name: diethyl 2-methyl-5-(3-quinolin-2-ylsulfanylpropanoylamino)furan-3,4-dicarboxylate Openeye Name: diethyl 2-methyl-5-[3-(2-quinolylsulfanyl)propanoylamino]furan-3,4-dicarboxylate CAS Name: 2-methyl-5-[[1-oxo-3-(2-quinolinylthio)propyl]amino]furan-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methyl-5-(3-quinolin-2-ylsulfanylpropanoylamino)furan-3,4-dicarboxylate Traditional Name: 2-methyl-5-[3-(2-quinolylthio)propanoylamino]furan-3,4-dicarboxylic acid diethyl ester Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)CCSC2=NC3=CC=CC=C3C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)CCSC2=NC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C23H24N2O6S/c1-4-29-22(27)19-14(3)31-21(20(19)23(28)30-5-2)25-17(26)12-13-32-18-11-10-15-8-6-7-9-16(15)24-18/h6-11H,4-5,12-13H2,1-3H3,(H,25,26)