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

Systemtic Name: diethyl 2-[3-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-5-methyl-furan-3,4-dicarboxylate Openeye Name: diethyl 2-[3-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoylamino]-5-methyl-furan-3,4-dicarboxylate CAS Name: 2-[[3-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxopropyl]amino]-5-methylfuran-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[3-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-5-methylfuran-3,4-dicarboxylate Traditional Name: 2-[3-[(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)CCSC2=NC3=C(C=CC=C3C)C(=C2)C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O6S/c1-6-31-24(29)20-16(5)33-23(21(20)25(30)32-7-2)26-18(28)11-12-34-19-13-15(4)17-10-8-9-14(3)22(17)27-19/h8-10,13H,6-7,11-12H2,1-5H3,(H,26,28)