N-(2-dimethylaminoethyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-dimethylaminoethyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-dimethylaminoethyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-dimethylaminoethyl)-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-dimethylaminoethyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carbothioamide Formula: C16H23F3N4O2S2 MolecularWeight: 424.50463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23F3N4O2S2/c1-21(2)7-6-20-15(26)22-8-10-23(11-9-22)27(24,25)14-5-3-4-13(12-14)16(17,18)19/h3-5,12H,6-11H2,1-2H3,(H,20,26)