propan-2-yl 4-(4-bromophenyl)-2-(ethanoylsulfanylmethyl)-4-oxidanylidene-butanoate

Systemtic Name: propan-2-yl 4-(4-bromophenyl)-2-(ethanoylsulfanylmethyl)-4-oxidanylidene-butanoate Openeye Name: isopropyl 2-(acetylsulfanylmethyl)-4-(4-bromophenyl)-4-oxo-butanoate CAS Name: 2-[(acetylthio)methyl]-4-(4-bromophenyl)-4-oxobutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(acetylsulfanylmethyl)-4-(4-bromophenyl)-4-oxobutanoate Traditional Name: 2-[(acetylthio)methyl]-4-(4-bromophenyl)-4-keto-butyric acid isopropyl ester Formula: C16H19BrO4S MolecularWeight: 387.28866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19BrO4S/c1-10(2)21-16(20)13(9-22-11(3)18)8-15(19)12-4-6-14(17)7-5-12/h4-7,10,13H,8-9H2,1-3H3