[2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: [2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 5-bromanyl-2-chloranyl-benzoate Openeye Name: [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [2-(N-acetyl-2-ethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-ethylanilino)-1,3-thiazol-4-yl]methyl 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl ester Formula: C21H18BrClN2O3S MolecularWeight: 493.80122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrClN2O3S/c1-3-14-6-4-5-7-19(14)25(13(2)26)21-24-16(12-29-21)11-28-20(27)17-10-15(22)8-9-18(17)23/h4-10,12H,3,11H2,1-2H3