diethyl 2-methyl-5-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]furan-3,4-dicarboxylate

Systemtic Name: diethyl 2-methyl-5-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]furan-3,4-dicarboxylate Openeye Name: diethyl 2-methyl-5-[2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanoylamino]furan-3,4-dicarboxylate CAS Name: 2-methyl-5-[[1-oxo-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butyl]amino]furan-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methyl-5-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]furan-3,4-dicarboxylate Traditional Name: 2-methyl-5-[2-[(4,6,8-trimethyl-2-quinolyl)thio]butanoylamino]furan-3,4-dicarboxylic acid diethyl ester Formula: C27H32N2O6S MolecularWeight: 512.61778

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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=C(C=C(C=C3C(=C2)C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H32N2O6S/c1-8-19(36-20-13-15(5)18-12-14(4)11-16(6)23(18)28-20)24(30)29-25-22(27(32)34-10-3)21(17(7)35-25)26(31)33-9-2/h11-13,19H,8-10H2,1-7H3,(H,29,30)