N,N-dimethyl-4-[(E)-3-[4-(trifluoromethylsulfanyl)phenyl]prop-2-enoyl]piperazine-1-sulfonamide

Systemtic Name: N,N-dimethyl-4-[(E)-3-[4-(trifluoromethylsulfanyl)phenyl]prop-2-enoyl]piperazine-1-sulfonamide Openeye Name: N,N-dimethyl-4-[(E)-3-[4-(trifluoromethylsulfanyl)phenyl]prop-2-enoyl]piperazine-1-sulfonamide CAS Name: N,N-dimethyl-4-[(E)-1-oxo-3-[4-(trifluoromethylthio)phenyl]prop-2-enyl]-1-piperazinesulfonamide IUPAC Name: N,N-dimethyl-4-[(E)-3-[4-(trifluoromethylsulfanyl)phenyl]prop-2-enoyl]piperazine-1-sulfonamide Traditional Name: N,N-dimethyl-4-[(E)-3-[4-(trifluoromethylthio)phenyl]acryloyl]piperazine-1-sulfonamide Formula: C16H20F3N3O3S2 MolecularWeight: 423.47351

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C=CC2=CC=C(C=C2)SC(F)(F)F

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)/C=C/C2=CC=C(C=C2)SC(F)(F)F

InChI

InChI=1S/C16H20F3N3O3S2/c1-20(2)27(24,25)22-11-9-21(10-12-22)15(23)8-5-13-3-6-14(7-4-13)26-16(17,18)19/h3-8H,9-12H2,1-2H3/b8-5+