N-[(1S)-1-(6-chloranyl-1H-benzimidazol-2-yl)-2-[3-fluoranyl-4-[(5S)-1,1,3-tris(oxidanylidene)-1,2-thiazolidin-5-yl]phenyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-[(1S)-1-(6-chloranyl-1H-benzimidazol-2-yl)-2-[3-fluoranyl-4-[(5S)-1,1,3-tris(oxidanylidene)-1,2-thiazolidin-5-yl]phenyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)-2-[3-fluoro-4-[(5S)-1,1,3-trioxo-1,2-thiazolidin-5-yl]phenyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide; 2,2,2-trifluoroacetic acid CAS Name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)-2-[3-fluoro-4-[(5S)-1,1,3-trioxo-1,2-thiazolidin-5-yl]phenyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)-2-[3-fluoro-4-[(5S)-1,1,3-trioxo-1,2-thiazolidin-5-yl]phenyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide; 2,2,2-trifluoroacetic acid Traditional Name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)-2-[3-fluoro-4-[(5S)-1,1,3-triketo-1,2-thiazolidin-5-yl]phenyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide; 2,2,2-trifluoroacetic acid Formula: C27H20ClF7N4O7S2 MolecularWeight: 745.042122

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Descriptors Computed from Structure

Canonical SMILES:

C1C(S(=O)(=O)NC1=O)C2=C(C=C(C=C2)CC(C3=NC4=C(N3)C=C(C=C4)Cl)NS(=O)(=O)C5=CC=CC(=C5)C(F)(F)F)F.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1[C@H](S(=O)(=O)NC1=O)C2=C(C=C(C=C2)C[C@@H](C3=NC4=C(N3)C=C(C=C4)Cl)NS(=O)(=O)C5=CC=CC(=C5)C(F)(F)F)F.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C25H19ClF4N4O5S2.C2HF3O2/c26-15-5-7-19-20(11-15)32-24(31-19)21(33-40(36,37)16-3-1-2-14(10-16)25(28,29)30)9-13-4-6-17(18(27)8-13)22-12-23(35)34-41(22,38)39;3-2(4,5)1(6)7/h1-8,10-11,21-22,33H,9,12H2,(H,31,32)(H,34,35);(H,6,7)/t21-,22-;/m0./s1