2-(3-ethoxy-4-pentoxy-phenyl)-1-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-(furan-2-ylcarbonyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 2-(3-ethoxy-4-pentoxy-phenyl)-1-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-(furan-2-ylcarbonyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 2-(3-ethoxy-4-pentoxy-phenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-3-(furan-2-carbonyl)-4-hydroxy-2H-pyrrol-5-one CAS Name: 2-(3-ethoxy-4-pentoxyphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-3-[2-furanyl(oxo)methyl]-4-hydroxy-2H-pyrrol-5-one IUPAC Name: 2-(3-ethoxy-4-pentoxyphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-3-(furan-2-carbonyl)-4-hydroxy-2H-pyrrol-5-one Traditional Name: 5-(4-amoxy-3-ethoxy-phenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-(2-furoyl)-3-hydroxy-3-pyrrolin-2-one Formula: C29H27FN2O6S MolecularWeight: 550.597883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)F)O)C(=O)C5=CC=CO5)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)F)O)C(=O)C5=CC=CO5)OCC

InChI

InChI=1S/C29H27FN2O6S/c1-3-5-6-13-37-20-12-9-17(15-22(20)36-4-2)25-24(26(33)21-8-7-14-38-21)27(34)28(35)32(25)29-31-19-11-10-18(30)16-23(19)39-29/h7-12,14-16,25,34H,3-6,13H2,1-2H3