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

Systemtic Name: (4E)-5-(4-hexoxyphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-hexoxyphenyl)-4-[hydroxy(4-pyridyl)methylene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-hexoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-hexoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-hexoxyphenyl)-4-[hydroxy(4-pyridyl)methylene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-quinone Formula: C25H26N4O4S MolecularWeight: 478.56334

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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=NN=C(S4)C

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O4S/c1-3-4-5-6-15-33-19-9-7-17(8-10-19)21-20(22(30)18-11-13-26-14-12-18)23(31)24(32)29(21)25-28-27-16(2)34-25/h7-14,21,30H,3-6,15H2,1-2H3/b22-20+