[2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 3-fluoranyl-4-methyl-benzoate

Systemtic Name: [2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 3-fluoranyl-4-methyl-benzoate Openeye Name: [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl 3-fluoro-4-methyl-benzoate CAS Name: 3-fluoro-4-methylbenzoic acid [2-(N-acetyl-2-ethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-ethylanilino)-1,3-thiazol-4-yl]methyl 3-fluoro-4-methylbenzoate Traditional Name: 3-fluoro-4-methyl-benzoic acid [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl ester Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(C2=NC(=CS2)COC(=O)C3=CC(=C(C=C3)C)F)C(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(C2=NC(=CS2)COC(=O)C3=CC(=C(C=C3)C)F)C(=O)C

InChI

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