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

Systemtic Name: diethyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylbutanoylamino]-5-methyl-furan-3,4-dicarboxylate Openeye Name: diethyl 2-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]butanoylamino]-5-methyl-furan-3,4-dicarboxylate CAS Name: 2-[[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxobutyl]amino]-5-methylfuran-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylbutanoylamino]-5-methylfuran-3,4-dicarboxylate Traditional Name: 2-[2-[(4,8-dimethyl-2-quinolyl)thio]butanoylamino]-5-methyl-furan-3,4-dicarboxylic acid diethyl ester Formula: C26H30N2O6S MolecularWeight: 498.5912

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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=CC=C3C)C(=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C26H30N2O6S/c1-7-18(35-19-13-15(5)17-12-10-11-14(4)22(17)27-19)23(29)28-24-21(26(31)33-9-3)20(16(6)34-24)25(30)32-8-2/h10-13,18H,7-9H2,1-6H3,(H,28,29)