[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C15H13BrO3S2 MolecularWeight: 385.29592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)OCC(=O)C2=CC=C(S2)Br

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)OCC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C15H13BrO3S2/c16-14-7-6-13(21-14)12(17)10-19-15(18)8-9-20-11-4-2-1-3-5-11/h1-7H,8-10H2