ethyl (5E)-5-[cyano-(4-thiophen-2-yl-1,3-thiazol-2-yl)methylidene]-4-phenyl-1,3,4-thiadiazole-2-carboxylate

Systemtic Name: ethyl (5E)-5-[cyano-(4-thiophen-2-yl-1,3-thiazol-2-yl)methylidene]-4-phenyl-1,3,4-thiadiazole-2-carboxylate Openeye Name: ethyl (5E)-5-[cyano-[4-(2-thienyl)thiazol-2-yl]methylene]-4-phenyl-1,3,4-thiadiazole-2-carboxylate CAS Name: (5E)-5-[cyano-(4-thiophen-2-yl-2-thiazolyl)methylidene]-4-phenyl-1,3,4-thiadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[cyano-(4-thiophen-2-yl-1,3-thiazol-2-yl)methylidene]-4-phenyl-1,3,4-thiadiazole-2-carboxylate Traditional Name: (5E)-5-[cyano-[4-(2-thienyl)thiazol-2-yl]methylene]-4-phenyl-1,3,4-thiadiazole-2-carboxylic acid ethyl ester Formula: C20H14N4O2S3 MolecularWeight: 438.54576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C(C#N)C2=NC(=CS2)C3=CC=CS3)S1)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(/C(=C(/C#N)\C2=NC(=CS2)C3=CC=CS3)/S1)C4=CC=CC=C4

InChI

InChI=1S/C20H14N4O2S3/c1-2-26-20(25)18-23-24(13-7-4-3-5-8-13)19(29-18)14(11-21)17-22-15(12-28-17)16-9-6-10-27-16/h3-10,12H,2H2,1H3/b19-14+