N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[4-(difluoromethylthio)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-1-keto-isochroman-3-carboxamide Formula: C17H13F2NO3S MolecularWeight: 349.351826

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C17H13F2NO3S/c18-17(19)24-12-7-5-11(6-8-12)20-15(21)14-9-10-3-1-2-4-13(10)16(22)23-14/h1-8,14,17H,9H2,(H,20,21)