ethyl 4-aminocarbonyl-2-methyl-5-[2-(4-methylquinolin-2-yl)sulfanylpropanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-2-methyl-5-[2-(4-methylquinolin-2-yl)sulfanylpropanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-carbamoyl-2-methyl-5-[2-[(4-methyl-2-quinolyl)sulfanyl]propanoylamino]furan-3-carboxylate CAS Name: 4-carbamoyl-2-methyl-5-[[2-[(4-methyl-2-quinolinyl)thio]-1-oxopropyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-2-methyl-5-[2-(4-methylquinolin-2-yl)sulfanylpropanoylamino]furan-3-carboxylate Traditional Name: 4-carbamoyl-2-methyl-5-[2-[(4-methyl-2-quinolyl)thio]propanoylamino]furan-3-carboxylic acid ethyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O5S/c1-5-29-22(28)17-12(3)30-21(18(17)19(23)26)25-20(27)13(4)31-16-10-11(2)14-8-6-7-9-15(14)24-16/h6-10,13H,5H2,1-4H3,(H2,23,26)(H,25,27)