ethyl 4-methyl-2-[2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[2-(4-methyl-2-oxo-1-quinolyl)butanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-(4-methyl-2-oxo-1-quinolinyl)-1-oxobutyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[2-(4-methyl-2-oxoquinolin-1-yl)butanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-(2-keto-4-methyl-1-quinolyl)butanoylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC)C)N2C3=CC=CC=C3C(=CC2=O)C

Isomeric SMILES

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC)C)N2C3=CC=CC=C3C(=CC2=O)C

InChI

InChI=1S/C21H23N3O4S/c1-5-15(24-16-10-8-7-9-14(16)12(3)11-17(24)25)19(26)23-21-22-13(4)18(29-21)20(27)28-6-2/h7-11,15H,5-6H2,1-4H3,(H,22,23,26)