[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate Openeye Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl] 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid [2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid [2-keto-2-(4-mesylpiperazino)ethyl] ester Formula: C15H19BrN2O5S2 MolecularWeight: 451.35576

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)CSC2=CC=C(C=C2)Br

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H19BrN2O5S2/c1-25(21,22)18-8-6-17(7-9-18)14(19)10-23-15(20)11-24-13-4-2-12(16)3-5-13/h2-5H,6-11H2,1H3