[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 2-chloranyl-6-fluoranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 2-chloranyl-6-fluoranyl-benzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester Formula: C21H15ClFNO3S MolecularWeight: 415.865103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)COC(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)COC(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H15ClFNO3S/c22-15-9-6-10-16(23)20(15)21(26)27-13-19(25)24-17-11-4-5-12-18(17)28-14-7-2-1-3-8-14/h1-12H,13H2,(H,24,25)