ethyl 2-[2-[[2,5-bis(bromanyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[[2,5-bis(bromanyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(2,5-dibromoanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2,5-dibromoanilino)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2,5-dibromoanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2,5-dibromoanilino)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C12H13Br2NO3S MolecularWeight: 411.10952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13Br2NO3S/c1-2-18-12(17)7-19-6-11(16)15-10-5-8(13)3-4-9(10)14/h3-5H,2,6-7H2,1H3,(H,15,16)