methyl 2,4-bis(fluoranyl)-5-(thiolan-3-ylamino)benzoate

Systemtic Name: methyl 2,4-bis(fluoranyl)-5-(thiolan-3-ylamino)benzoate Openeye Name: methyl 2,4-difluoro-5-(tetrahydrothiophen-3-ylamino)benzoate CAS Name: 2,4-difluoro-5-(3-thiolanylamino)benzoic acid methyl ester IUPAC Name: methyl 2,4-difluoro-5-(thiolan-3-ylamino)benzoate Traditional Name: 2,4-difluoro-5-(tetrahydrothiophen-3-ylamino)benzoic acid methyl ester Formula: C12H13F2NO2S MolecularWeight: 273.298926

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC2CCSC2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC2CCSC2

InChI

InChI=1S/C12H13F2NO2S/c1-17-12(16)8-4-11(10(14)5-9(8)13)15-7-2-3-18-6-7/h4-5,7,15H,2-3,6H2,1H3