2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-1-(1H-indol-3-yl)-2-phenyl-ethanone

Systemtic Name: 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-1-(1H-indol-3-yl)-2-phenyl-ethanone Openeye Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]-1-(1H-indol-3-yl)-2-phenyl-ethanone CAS Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-1-(1H-indol-3-yl)-2-phenylethanone IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-1-(1H-indol-3-yl)-2-phenylethanone Traditional Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]-1-(1H-indol-3-yl)-2-phenyl-ethanone Formula: C22H14ClF3N2OS MolecularWeight: 446.87257

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CNC3=CC=CC=C32)SC4=C(C=C(C=N4)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CNC3=CC=CC=C32)SC4=C(C=C(C=N4)C(F)(F)F)Cl

InChI

InChI=1S/C22H14ClF3N2OS/c23-17-10-14(22(24,25)26)11-28-21(17)30-20(13-6-2-1-3-7-13)19(29)16-12-27-18-9-5-4-8-15(16)18/h1-12,20,27H