(4E)-5-(3-ethoxy-4-pentoxy-phenyl)-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(3-ethoxy-4-pentoxy-phenyl)-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(3-ethoxy-4-pentoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione CAS Name: (4E)-5-(3-ethoxy-4-pentoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(3-ethoxy-4-pentoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-amoxy-3-ethoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-quinone Formula: C33H34N4O5S2 MolecularWeight: 630.77686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC=NC=C3)O)C(=O)C(=O)N2C4=NN=C(S4)SCC5=CC=C(C=C5)C)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2C4=NN=C(S4)SCC5=CC=C(C=C5)C)OCC

InChI

InChI=1S/C33H34N4O5S2/c1-4-6-7-18-42-25-13-12-24(19-26(25)41-5-2)28-27(29(38)23-14-16-34-17-15-23)30(39)31(40)37(28)32-35-36-33(44-32)43-20-22-10-8-21(3)9-11-22/h8-17,19,28,38H,4-7,18,20H2,1-3H3/b29-27+