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

Systemtic Name: N-(2-dimethylaminoethyl)-4-[2,3,4-tris(fluoranyl)phenyl]sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-dimethylaminoethyl)-4-(2,3,4-trifluorophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-dimethylaminoethyl)-4-(2,3,4-trifluorophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(2,3,4-trifluorophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-dimethylaminoethyl)-4-(2,3,4-trifluorophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C15H21F3N4O2S2 MolecularWeight: 410.47805

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

CN(C)CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C15H21F3N4O2S2/c1-20(2)6-5-19-15(25)21-7-9-22(10-8-21)26(23,24)12-4-3-11(16)13(17)14(12)18/h3-4H,5-10H2,1-2H3,(H,19,25)