N-butyl-4-[2,3,4-tris(fluoranyl)phenyl]sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-butyl-4-[2,3,4-tris(fluoranyl)phenyl]sulfonyl-piperazine-1-carbothioamide Openeye Name: N-butyl-4-(2,3,4-trifluorophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-butyl-4-(2,3,4-trifluorophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-butyl-4-(2,3,4-trifluorophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-butyl-4-(2,3,4-trifluorophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C15H20F3N3O2S2 MolecularWeight: 395.46341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

CCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C15H20F3N3O2S2/c1-2-3-6-19-15(24)20-7-9-21(10-8-20)25(22,23)12-5-4-11(16)13(17)14(12)18/h4-5H,2-3,6-10H2,1H3,(H,19,24)