(E)-1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]but-2-en-1-one CAS Name: (E)-1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]but-2-en-1-one Traditional Name: (E)-1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]but-2-en-1-one Formula: C12H15BrN2O3S2 MolecularWeight: 379.2931

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

C/C=C/C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C12H15BrN2O3S2/c1-2-3-11(16)14-6-8-15(9-7-14)20(17,18)12-5-4-10(13)19-12/h2-5H,6-9H2,1H3/b3-2+