[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: [2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: [2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl] 2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(4-fluorophenyl)-4-methyl-5-thiazolecarboxylic acid [2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethyl-6-methylanilino)-2-oxoethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxylic acid [2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl] ester Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)COC(=O)C2=C(N=C(S2)C3=CC=C(C=C3)F)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)COC(=O)C2=C(N=C(S2)C3=CC=C(C=C3)F)C)C

InChI

InChI=1S/C22H21FN2O3S/c1-4-15-7-5-6-13(2)19(15)25-18(26)12-28-22(27)20-14(3)24-21(29-20)16-8-10-17(23)11-9-16/h5-11H,4,12H2,1-3H3,(H,25,26)