2-[2-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]thiazol-4-yl]acetate CAS Name: 2-[2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylthio]-4-thiazolyl]acetate IUPAC Name: 2-[2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylthio]thiazol-4-yl]acetate Formula: C20H15FNO4S2- MolecularWeight: 416.465803

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)CSC4=NC(=CS4)CC(=O)[O-])F

Isomeric SMILES

C1C2=CC(=CC(=C2O[C@H](O1)C3=CC=CC=C3)CSC4=NC(=CS4)CC(=O)[O-])F

InChI

InChI=1S/C20H16FNO4S2/c21-15-6-13-9-25-19(12-4-2-1-3-5-12)26-18(13)14(7-15)10-27-20-22-16(11-28-20)8-17(23)24/h1-7,11,19H,8-10H2,(H,23,24)/p-1/t19-/m0/s1