[(1S)-2-oxidanylidenecyclopentyl] 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclopentyl] 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: [(1S)-2-oxocyclopentyl] 2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]benzoic acid [(1S)-2-oxocyclopentyl] ester IUPAC Name: [(1S)-2-oxocyclopentyl] 2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]benzoic acid [(1S)-2-ketocyclopentyl] ester Formula: C20H18FNO4S MolecularWeight: 387.424623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C1)OC(=O)C2=CC=CC=C2SCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1C[C@@H](C(=O)C1)OC(=O)C2=CC=CC=C2SCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H18FNO4S/c21-13-8-10-14(11-9-13)22-19(24)12-27-18-7-2-1-4-15(18)20(25)26-17-6-3-5-16(17)23/h1-2,4,7-11,17H,3,5-6,12H2,(H,22,24)/t17-/m0/s1