(4E)-5-(4-butoxy-3-ethoxy-phenyl)-1-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(4-butoxy-3-ethoxy-phenyl)-1-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-1-(5-acetyl-4-methyl-thiazol-2-yl)-5-(4-butoxy-3-ethoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-dione CAS Name: (4E)-1-(5-acetyl-4-methyl-2-thiazolyl)-5-(4-butoxy-3-ethoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione IUPAC Name: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-butoxy-3-ethoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-1-(5-acetyl-4-methyl-thiazol-2-yl)-5-(4-butoxy-3-ethoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-quinone Formula: C28H29N3O6S MolecularWeight: 535.61136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC=NC=C3)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2C4=NC(=C(S4)C(=O)C)C)OCC

InChI

InChI=1S/C28H29N3O6S/c1-5-7-14-37-20-9-8-19(15-21(20)36-6-2)23-22(24(33)18-10-12-29-13-11-18)25(34)27(35)31(23)28-30-16(3)26(38-28)17(4)32/h8-13,15,23,33H,5-7,14H2,1-4H3/b24-22+