3-[[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]-4-fluoro-benzothiophene-2-carboxylic acid CAS Name: 3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(1,1-diketo-1,2-thiazolidin-2-yl)methyl]-4-fluoro-benzothiophene-2-carboxylic acid Formula: C13H12FNO4S2 MolecularWeight: 329.367083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(S(=O)(=O)C1)CC2=C(SC3=CC=CC(=C32)F)C(=O)O

Isomeric SMILES

C1CN(S(=O)(=O)C1)CC2=C(SC3=CC=CC(=C32)F)C(=O)O

InChI

InChI=1S/C13H12FNO4S2/c14-9-3-1-4-10-11(9)8(12(20-10)13(16)17)7-15-5-2-6-21(15,18)19/h1,3-4H,2,5-7H2,(H,16,17)