3-[4-[5-[(4-fluorophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoate

Systemtic Name: 3-[4-[5-[(4-fluorophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoate Openeye Name: 3-[4-[5-[(4-fluorophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoylamino]benzoate CAS Name: 3-[[4-[5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-1-oxobutyl]amino]benzoate IUPAC Name: 3-[4-[5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoate Traditional Name: 3-[4-[5-(4-fluorobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butanoylamino]benzoate Formula: C21H16FN2O4S2- MolecularWeight: 443.491143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C(=CC3=CC=C(C=C3)F)SC2=S)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C(=CC3=CC=C(C=C3)F)SC2=S)C(=O)[O-]

InChI

InChI=1S/C21H17FN2O4S2/c22-15-8-6-13(7-9-15)11-17-19(26)24(21(29)30-17)10-2-5-18(25)23-16-4-1-3-14(12-16)20(27)28/h1,3-4,6-9,11-12H,2,5,10H2,(H,23,25)(H,27,28)/p-1