(4E)-5-(4-hexoxyphenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(4-hexoxyphenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-hexoxyphenyl)-4-[hydroxy(4-pyridyl)methylene]-1-thiazol-2-yl-pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-hexoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(2-thiazolyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-hexoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-hexoxyphenyl)-4-[hydroxy(4-pyridyl)methylene]-1-thiazol-2-yl-pyrrolidine-2,3-quinone Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2C(=C(C3=CC=NC=C3)O)C(=O)C(=O)N2C4=NC=CS4

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2C4=NC=CS4

InChI

InChI=1S/C25H25N3O4S/c1-2-3-4-5-15-32-19-8-6-17(7-9-19)21-20(22(29)18-10-12-26-13-11-18)23(30)24(31)28(21)25-27-14-16-33-25/h6-14,16,21,29H,2-5,15H2,1H3/b22-20+