[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]benzoate

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]benzoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 2-[4-(difluoromethylsulfanyl)anilino]benzoate CAS Name: 2-[4-(difluoromethylthio)anilino]benzoic acid [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] 2-[4-(difluoromethylsulfanyl)anilino]benzoate Traditional Name: 2-[4-(difluoromethylthio)anilino]benzoic acid [2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C25H23F2NO3S MolecularWeight: 455.516826

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC=CC=C2NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC=CC=C2NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C25H23F2NO3S/c1-3-17-8-10-18(11-9-17)23(29)16(2)31-24(30)21-6-4-5-7-22(21)28-19-12-14-20(15-13-19)32-25(26)27/h4-16,25,28H,3H2,1-2H3