2-[[5-[bis(fluoranyl)methylsulfanylmethyl]furan-2-yl]carbonylamino]butanoic acid

Systemtic Name: 2-[[5-[bis(fluoranyl)methylsulfanylmethyl]furan-2-yl]carbonylamino]butanoic acid Openeye Name: 2-[[5-(difluoromethylsulfanylmethyl)furan-2-carbonyl]amino]butanoic acid CAS Name: 2-[[[5-[(difluoromethylthio)methyl]-2-furanyl]-oxomethyl]amino]butanoic acid IUPAC Name: 2-[[5-(difluoromethylsulfanylmethyl)furan-2-carbonyl]amino]butanoic acid Traditional Name: 2-[[5-[(difluoromethylthio)methyl]-2-furoyl]amino]butyric acid Formula: C11H13F2NO4S MolecularWeight: 293.287026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC=C(O1)CSC(F)F

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC=C(O1)CSC(F)F

InChI

InChI=1S/C11H13F2NO4S/c1-2-7(10(16)17)14-9(15)8-4-3-6(18-8)5-19-11(12)13/h3-4,7,11H,2,5H2,1H3,(H,14,15)(H,16,17)