4-(1-benzofuran-2-ylcarbonyl)-N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(1-benzofuran-2-ylcarbonyl)-N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]piperazine-1-carboxamide Openeye Name: 4-(benzofuran-2-carbonyl)-N-[2-(difluoromethylsulfanyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[2-benzofuranyl(oxo)methyl]-N-[2-(difluoromethylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(1-benzofuran-2-carbonyl)-N-[2-(difluoromethylsulfanyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(benzofuran-2-carbonyl)-N-[2-(difluoromethylthio)phenyl]piperazine-1-carboxamide Formula: C21H19F2N3O3S MolecularWeight: 431.455666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3O2)C(=O)NC4=CC=CC=C4SC(F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3O2)C(=O)NC4=CC=CC=C4SC(F)F

InChI

InChI=1S/C21H19F2N3O3S/c22-20(23)30-18-8-4-2-6-15(18)24-21(28)26-11-9-25(10-12-26)19(27)17-13-14-5-1-3-7-16(14)29-17/h1-8,13,20H,9-12H2,(H,24,28)