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

Systemtic Name: (4E)-1-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-5-(4-hexoxyphenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-1-(5-acetyl-4-methyl-thiazol-2-yl)-5-(4-hexoxyphenyl)-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-dione CAS Name: (4E)-1-(5-acetyl-4-methyl-2-thiazolyl)-5-(4-hexoxyphenyl)-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-hexoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-1-(5-acetyl-4-methyl-thiazol-2-yl)-5-(4-hexoxyphenyl)-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-quinone Formula: C28H29N3O5S MolecularWeight: 519.61196

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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(=C(S4)C(=O)C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2C4=NC(=C(S4)C(=O)C)C

InChI

InChI=1S/C28H29N3O5S/c1-4-5-6-7-16-36-21-10-8-19(9-11-21)23-22(24(33)20-12-14-29-15-13-20)25(34)27(35)31(23)28-30-17(2)26(37-28)18(3)32/h8-15,23,33H,4-7,16H2,1-3H3/b24-22+