(4E)-4-[(2,5-dimethylphenyl)-oxidanyl-methylidene]-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(furan-2-yl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(2,5-dimethylphenyl)-oxidanyl-methylidene]-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(furan-2-yl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(2-furyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[(2,5-dimethylphenyl)-hydroxymethylidene]-1-[5-[(4-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-5-(2-furanyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(2,5-dimethylphenyl)-hydroxymethylidene]-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(furan-2-yl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-1-[5-[(4-fluorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-5-(2-furyl)pyrrolidine-2,3-quinone Formula: C26H20FN3O4S2 MolecularWeight: 521.583103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=C2C(N(C(=O)C2=O)C3=NN=C(S3)SCC4=CC=C(C=C4)F)C5=CC=CO5)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C(=C\2/C(N(C(=O)C2=O)C3=NN=C(S3)SCC4=CC=C(C=C4)F)C5=CC=CO5)/O

InChI

InChI=1S/C26H20FN3O4S2/c1-14-5-6-15(2)18(12-14)22(31)20-21(19-4-3-11-34-19)30(24(33)23(20)32)25-28-29-26(36-25)35-13-16-7-9-17(27)10-8-16/h3-12,21,31H,13H2,1-2H3/b22-20+