diethyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-5-methyl-furan-3,4-dicarboxylate

Systemtic Name: diethyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-5-methyl-furan-3,4-dicarboxylate Openeye Name: diethyl 2-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoylamino]-5-methyl-furan-3,4-dicarboxylate CAS Name: 2-[[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxopropyl]amino]-5-methylfuran-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-5-methylfuran-3,4-dicarboxylate Traditional Name: 2-[2-[(4,8-dimethyl-2-quinolyl)thio]propanoylamino]-5-methyl-furan-3,4-dicarboxylic acid diethyl ester Formula: C25H28N2O6S MolecularWeight: 484.56462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)C(C)SC2=NC3=C(C=CC=C3C)C(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)C(C)SC2=NC3=C(C=CC=C3C)C(=C2)C)C

InChI

InChI=1S/C25H28N2O6S/c1-7-31-24(29)19-15(5)33-23(20(19)25(30)32-8-2)27-22(28)16(6)34-18-12-14(4)17-11-9-10-13(3)21(17)26-18/h9-12,16H,7-8H2,1-6H3,(H,27,28)