(2E)-2-[3-(4-bromophenyl)-5-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-2-cyano-N-(phenylmethyl)ethanamide

Systemtic Name: (2E)-2-[3-(4-bromophenyl)-5-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-2-cyano-N-(phenylmethyl)ethanamide Openeye Name: (2E)-N-benzyl-2-[3-(4-bromophenyl)-5-ethyl-4-oxo-thiazolidin-2-ylidene]-2-cyano-acetamide CAS Name: (2E)-2-[3-(4-bromophenyl)-5-ethyl-4-oxo-2-thiazolidinylidene]-2-cyano-N-(phenylmethyl)acetamide IUPAC Name: (2E)-N-benzyl-2-[3-(4-bromophenyl)-5-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide Traditional Name: (2E)-N-benzyl-2-[3-(4-bromophenyl)-5-ethyl-4-keto-thiazolidin-2-ylidene]-2-cyano-acetamide Formula: C21H18BrN3O2S MolecularWeight: 456.35552

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C(=C(C#N)C(=O)NCC2=CC=CC=C2)S1)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC1C(=O)N(/C(=C(/C#N)\C(=O)NCC2=CC=CC=C2)/S1)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrN3O2S/c1-2-18-20(27)25(16-10-8-15(22)9-11-16)21(28-18)17(12-23)19(26)24-13-14-6-4-3-5-7-14/h3-11,18H,2,13H2,1H3,(H,24,26)/b21-17+