4-[[4-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanylanilino]-4-oxo-butanoic acid CAS Name: 4-[4-[[2-(4-fluorophenyl)-2-oxoethyl]thio]anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylanilino]-4-oxobutanoic acid Traditional Name: 4-[4-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]anilino]-4-keto-butyric acid Formula: C18H16FNO4S MolecularWeight: 361.387343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CSC2=CC=C(C=C2)NC(=O)CCC(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CSC2=CC=C(C=C2)NC(=O)CCC(=O)O)F

InChI

InChI=1S/C18H16FNO4S/c19-13-3-1-12(2-4-13)16(21)11-25-15-7-5-14(6-8-15)20-17(22)9-10-18(23)24/h1-8H,9-11H2,(H,20,22)(H,23,24)