1-[4-[2,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-4-thiophen-2-yl-butane-1,4-dione

Systemtic Name: 1-[4-[2,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-4-thiophen-2-yl-butane-1,4-dione Openeye Name: 1-[4-(2,4-difluorophenyl)sulfonylpiperazin-1-yl]-4-(2-thienyl)butane-1,4-dione CAS Name: 1-[4-(2,4-difluorophenyl)sulfonyl-1-piperazinyl]-4-thiophen-2-ylbutane-1,4-dione IUPAC Name: 1-[4-(2,4-difluorophenyl)sulfonylpiperazin-1-yl]-4-thiophen-2-ylbutane-1,4-dione Traditional Name: 1-[4-(2,4-difluorophenyl)sulfonylpiperazino]-4-(2-thienyl)butane-1,4-dione Formula: C18H18F2N2O4S2 MolecularWeight: 428.473326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=CS2)S(=O)(=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=CS2)S(=O)(=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C18H18F2N2O4S2/c19-13-3-5-17(14(20)12-13)28(25,26)22-9-7-21(8-10-22)18(24)6-4-15(23)16-2-1-11-27-16/h1-3,5,11-12H,4,6-10H2