2-[bis(fluoranyl)methylsulfanyl]-N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)pyridine-3-carboxamide

Systemtic Name: 2-[bis(fluoranyl)methylsulfanyl]-N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)pyridine-3-carboxamide Openeye Name: 2-(difluoromethylsulfanyl)-N-(6-fluorothiochroman-4-yl)pyridine-3-carboxamide CAS Name: 2-(difluoromethylthio)-N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-pyridinecarboxamide IUPAC Name: 2-(difluoromethylsulfanyl)-N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)pyridine-3-carboxamide Traditional Name: 2-(difluoromethylthio)-N-(6-fluorothiochroman-4-yl)nicotinamide Formula: C16H13F3N2OS2 MolecularWeight: 370.41243

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC(=O)C3=C(N=CC=C3)SC(F)F)C=C(C=C2)F

Isomeric SMILES

C1CSC2=C(C1NC(=O)C3=C(N=CC=C3)SC(F)F)C=C(C=C2)F

InChI

InChI=1S/C16H13F3N2OS2/c17-9-3-4-13-11(8-9)12(5-7-23-13)21-14(22)10-2-1-6-20-15(10)24-16(18)19/h1-4,6,8,12,16H,5,7H2,(H,21,22)