N-propyl-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-propyl-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carbothioamide Openeye Name: N-propyl-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carbothioamide CAS Name: N-propyl-4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-propyl-4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbothioamide Traditional Name: N-propyl-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carbothioamide Formula: C15H20F3N3O2S2 MolecularWeight: 395.46341

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H20F3N3O2S2/c1-2-7-19-14(24)20-8-10-21(11-9-20)25(22,23)13-5-3-12(4-6-13)15(16,17)18/h3-6H,2,7-11H2,1H3,(H,19,24)