(4E)-5-(3-ethoxy-4-propoxy-phenyl)-1-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-oxidanyl-methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(3-ethoxy-4-propoxy-phenyl)-1-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-oxidanyl-methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(3-ethoxy-4-propoxy-phenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydrobenzofuran-5-yl)methylene]pyrrolidine-2,3-dione CAS Name: (4E)-5-(3-ethoxy-4-propoxyphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydrobenzofuran-5-yl)methylidene]pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(3-ethoxy-4-propoxyphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-5-(3-ethoxy-4-propoxy-phenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy-(2-methylcoumaran-5-yl)methylene]pyrrolidine-2,3-quinone Formula: C32H29FN2O6S MolecularWeight: 588.645863

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)F)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC4=C(C=C3)OC(C4)C)\O)/C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)F)OCC

InChI

InChI=1S/C32H29FN2O6S/c1-4-12-40-24-11-6-18(15-25(24)39-5-2)28-27(29(36)19-7-10-23-20(14-19)13-17(3)41-23)30(37)31(38)35(28)32-34-22-9-8-21(33)16-26(22)42-32/h6-11,14-17,28,36H,4-5,12-13H2,1-3H3/b29-27+