[2-[ethanoyl-(4-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 5-bromanylfuran-2-carboxylate

Systemtic Name: [2-[ethanoyl-(4-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 5-bromanylfuran-2-carboxylate Openeye Name: [2-(N-acetyl-4-ethyl-anilino)thiazol-4-yl]methyl 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid [2-(N-acetyl-4-ethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-4-ethylanilino)-1,3-thiazol-4-yl]methyl 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid [2-(N-acetyl-4-ethyl-anilino)thiazol-4-yl]methyl ester Formula: C19H17BrN2O4S MolecularWeight: 449.31828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=CC=C(O3)Br)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=CC=C(O3)Br)C(=O)C

InChI

InChI=1S/C19H17BrN2O4S/c1-3-13-4-6-15(7-5-13)22(12(2)23)19-21-14(11-27-19)10-25-18(24)16-8-9-17(20)26-16/h4-9,11H,3,10H2,1-2H3