ethyl 4-(4-bromophenyl)-2-(ethanoylsulfanylmethyl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-(ethanoylsulfanylmethyl)-4-oxidanylidene-butanoate Openeye Name: ethyl 2-(acetylsulfanylmethyl)-4-(4-bromophenyl)-4-oxo-butanoate CAS Name: 2-[(acetylthio)methyl]-4-(4-bromophenyl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(acetylsulfanylmethyl)-4-(4-bromophenyl)-4-oxobutanoate Traditional Name: 2-[(acetylthio)methyl]-4-(4-bromophenyl)-4-keto-butyric acid ethyl ester Formula: C15H17BrO4S MolecularWeight: 373.26208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC=C(C=C1)Br)CSC(=O)C

Isomeric SMILES

CCOC(=O)C(CC(=O)C1=CC=C(C=C1)Br)CSC(=O)C

InChI

InChI=1S/C15H17BrO4S/c1-3-20-15(19)12(9-21-10(2)17)8-14(18)11-4-6-13(16)7-5-11/h4-7,12H,3,8-9H2,1-2H3