[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-[2-(4-butoxyanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-butoxyanilino)-2-oxoethyl]thio]acetic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-[2-(4-butoxyanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-butoxyanilino)-2-keto-ethyl]thio]acetic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C22H24BrNO5S MolecularWeight: 494.39866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)CSCC(=O)OCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)CSCC(=O)OCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C22H24BrNO5S/c1-2-3-12-28-19-10-8-18(9-11-19)24-21(26)14-30-15-22(27)29-13-20(25)16-4-6-17(23)7-5-16/h4-11H,2-3,12-15H2,1H3,(H,24,26)