2-[[2-[(3,4-dimethoxyphenyl)methyl]-7-fluoranyl-3-oxidanylidene-1H-isoindol-1-yl]sulfanyl]-N-pyridin-2-yl-ethanamide

Systemtic Name: 2-[[2-[(3,4-dimethoxyphenyl)methyl]-7-fluoranyl-3-oxidanylidene-1H-isoindol-1-yl]sulfanyl]-N-pyridin-2-yl-ethanamide Openeye Name: 2-[2-[(3,4-dimethoxyphenyl)methyl]-7-fluoro-3-oxo-isoindolin-1-yl]sulfanyl-N-(2-pyridyl)acetamide CAS Name: 2-[[2-[(3,4-dimethoxyphenyl)methyl]-7-fluoro-3-oxo-1H-isoindol-1-yl]thio]-N-(2-pyridinyl)acetamide IUPAC Name: 2-[[2-[(3,4-dimethoxyphenyl)methyl]-7-fluoro-3-oxo-1H-isoindol-1-yl]sulfanyl]-N-pyridin-2-ylacetamide Traditional Name: 2-[(7-fluoro-3-keto-2-veratryl-isoindolin-1-yl)thio]-N-(2-pyridyl)acetamide Formula: C24H22FN3O4S MolecularWeight: 467.512583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(C3=C(C2=O)C=CC=C3F)SCC(=O)NC4=CC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(C3=C(C2=O)C=CC=C3F)SCC(=O)NC4=CC=CC=N4)OC

InChI

InChI=1S/C24H22FN3O4S/c1-31-18-10-9-15(12-19(18)32-2)13-28-23(30)16-6-5-7-17(25)22(16)24(28)33-14-21(29)27-20-8-3-4-11-26-20/h3-12,24H,13-14H2,1-2H3,(H,26,27,29)