2-[(3S)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-3-yl]-1,3-benzothiazole

Systemtic Name: 2-[(3S)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-3-yl]-1,3-benzothiazole Openeye Name: 2-[(3S)-1-[3-(trifluoromethyl)phenyl]sulfonyl-3-piperidyl]-1,3-benzothiazole CAS Name: 2-[(3S)-1-[3-(trifluoromethyl)phenyl]sulfonyl-3-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[(3S)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-3-yl]-1,3-benzothiazole Traditional Name: 2-[(3S)-1-[3-(trifluoromethyl)phenyl]sulfonyl-3-piperidyl]-1,3-benzothiazole Formula: C19H17F3N2O2S2 MolecularWeight: 426.47569

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H17F3N2O2S2/c20-19(21,22)14-6-3-7-15(11-14)28(25,26)24-10-4-5-13(12-24)18-23-16-8-1-2-9-17(16)27-18/h1-3,6-9,11,13H,4-5,10,12H2/t13-/m0/s1