ethyl 4-methyl-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[2-[(4,6,8-trimethyl-2-quinolyl)thio]butanoylamino]thiazole-5-carboxylic acid ethyl ester Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC)C)SC2=NC3=C(C=C(C=C3C(=C2)C)C)C

Isomeric SMILES

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC)C)SC2=NC3=C(C=C(C=C3C(=C2)C)C)C

InChI

InChI=1S/C23H27N3O3S2/c1-7-17(21(27)26-23-24-15(6)20(31-23)22(28)29-8-2)30-18-11-13(4)16-10-12(3)9-14(5)19(16)25-18/h9-11,17H,7-8H2,1-6H3,(H,24,26,27)