(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (3-phenyl-2-thioxo-1H-imidazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: (3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (3-phenyl-2-thioxo-4-imidazolin-4-yl)-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C21H19F3N4O3S2 MolecularWeight: 496.52577

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CNC(=S)N2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CNC(=S)N2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H19F3N4O3S2/c22-21(23,24)16-8-4-5-9-18(16)33(30,31)27-12-10-26(11-13-27)19(29)17-14-25-20(32)28(17)15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,25,32)