ethyl 4-methyl-2-[2-(3,7,8-trimethylquinolin-2-yl)sulfanylethanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-(3,7,8-trimethylquinolin-2-yl)sulfanylethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-[(3,7,8-trimethyl-2-quinolyl)sulfanyl]acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[(3,7,8-trimethyl-2-quinolinyl)thio]ethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-(3,7,8-trimethylquinolin-2-yl)sulfanylacetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-[(3,7,8-trimethyl-2-quinolyl)thio]acetyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=C(C=C3C=CC(=C(C3=N2)C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=C(C=C3C=CC(=C(C3=N2)C)C)C)C

InChI

InChI=1S/C21H23N3O3S2/c1-6-27-20(26)18-14(5)22-21(29-18)23-16(25)10-28-19-12(3)9-15-8-7-11(2)13(4)17(15)24-19/h7-9H,6,10H2,1-5H3,(H,22,23,25)