ethyl 2-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C12H13BrFNO3S MolecularWeight: 350.203923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=C(C=C(C=C1)Br)F

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C12H13BrFNO3S/c1-2-18-12(17)7-19-6-11(16)15-10-4-3-8(13)5-9(10)14/h3-5H,2,6-7H2,1H3,(H,15,16)