ethyl 4-ethanoyl-5-methyl-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-5-methyl-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-acetyl-5-methyl-2-[2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanoylamino]furan-3-carboxylate CAS Name: 4-acetyl-5-methyl-2-[[1-oxo-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-5-methyl-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]furan-3-carboxylate Traditional Name: 4-acetyl-5-methyl-2-[2-[(4,6,8-trimethyl-2-quinolyl)thio]butanoylamino]furan-3-carboxylic acid ethyl ester Formula: C26H30N2O5S MolecularWeight: 482.5918

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H30N2O5S/c1-8-19(34-20-12-14(4)18-11-13(3)10-15(5)23(18)27-20)24(30)28-25-22(26(31)32-9-2)21(16(6)29)17(7)33-25/h10-12,19H,8-9H2,1-7H3,(H,28,30)