methyl 2-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]-4-ethyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]-4-ethyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[4-(4-chloro-3,5-dimethyl-phenoxy)butanoylamino]-4-ethyl-thiazole-5-carboxylate CAS Name: 2-[[4-(4-chloro-3,5-dimethylphenoxy)-1-oxobutyl]amino]-4-ethyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(4-chloro-3,5-dimethylphenoxy)butanoylamino]-4-ethyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[4-(4-chloro-3,5-dimethyl-phenoxy)butanoylamino]-4-ethyl-thiazole-5-carboxylic acid methyl ester Formula: C19H23ClN2O4S MolecularWeight: 410.91492

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)NC(=O)CCCOC2=CC(=C(C(=C2)C)Cl)C)C(=O)OC

Isomeric SMILES

CCC1=C(SC(=N1)NC(=O)CCCOC2=CC(=C(C(=C2)C)Cl)C)C(=O)OC

InChI

InChI=1S/C19H23ClN2O4S/c1-5-14-17(18(24)25-4)27-19(21-14)22-15(23)7-6-8-26-13-9-11(2)16(20)12(3)10-13/h9-10H,5-8H2,1-4H3,(H,21,22,23)