2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-1,3-benzothiazole

Systemtic Name: 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-1,3-benzothiazole Openeye Name: 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-1,3-benzothiazole CAS Name: 2-[[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-1,3-benzothiazole IUPAC Name: 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-1,3-benzothiazole Traditional Name: 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]methyl]-1,3-benzothiazole Formula: C19H18F3N3O2S2 MolecularWeight: 441.49033

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C19H18F3N3O2S2/c20-19(21,22)14-4-3-5-15(12-14)29(26,27)25-10-8-24(9-11-25)13-18-23-16-6-1-2-7-17(16)28-18/h1-7,12H,8-11,13H2