1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-(4-fluorophenyl)butane-1,4-dione

Systemtic Name: 1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-(4-fluorophenyl)butane-1,4-dione Openeye Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-4-(4-fluorophenyl)butane-1,4-dione CAS Name: 1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-4-(4-fluorophenyl)butane-1,4-dione IUPAC Name: 1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-4-(4-fluorophenyl)butane-1,4-dione Traditional Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-4-(4-fluorophenyl)butane-1,4-dione Formula: C18H18BrFN2O4S2 MolecularWeight: 489.378923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C18H18BrFN2O4S2/c19-16-6-8-18(27-16)28(25,26)22-11-9-21(10-12-22)17(24)7-5-15(23)13-1-3-14(20)4-2-13/h1-4,6,8H,5,7,9-12H2