2-[[3-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]methyl]-1H-isoindol-1-yl]sulfanyl]-N-pyridin-2-yl-ethanamide

Systemtic Name: 2-[[3-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]methyl]-1H-isoindol-1-yl]sulfanyl]-N-pyridin-2-yl-ethanamide Openeye Name: 2-[3-oxo-2-[[4-(trifluoromethoxy)phenyl]methyl]isoindolin-1-yl]sulfanyl-N-(2-pyridyl)acetamide CAS Name: 2-[[3-oxo-2-[[4-(trifluoromethoxy)phenyl]methyl]-1H-isoindol-1-yl]thio]-N-(2-pyridinyl)acetamide IUPAC Name: 2-[[3-oxo-2-[[4-(trifluoromethoxy)phenyl]methyl]-1H-isoindol-1-yl]sulfanyl]-N-pyridin-2-ylacetamide Traditional Name: 2-[[3-keto-2-[4-(trifluoromethoxy)benzyl]isoindolin-1-yl]thio]-N-(2-pyridyl)acetamide Formula: C23H18F3N3O3S MolecularWeight: 473.46753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CC3=CC=C(C=C3)OC(F)(F)F)SCC(=O)NC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(N(C2=O)CC3=CC=C(C=C3)OC(F)(F)F)SCC(=O)NC4=CC=CC=N4

InChI

InChI=1S/C23H18F3N3O3S/c24-23(25,26)32-16-10-8-15(9-11-16)13-29-21(31)17-5-1-2-6-18(17)22(29)33-14-20(30)28-19-7-3-4-12-27-19/h1-12,22H,13-14H2,(H,27,28,30)