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

Systemtic Name: (2E)-2-[(5S)-3-(4-bromophenyl)-5-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-2-cyano-N-phenethyl-ethanamide Openeye Name: (2E)-2-[(5S)-3-(4-bromophenyl)-5-ethyl-4-oxo-thiazolidin-2-ylidene]-2-cyano-N-phenethyl-acetamide CAS Name: (2E)-2-[(5S)-3-(4-bromophenyl)-5-ethyl-4-oxo-2-thiazolidinylidene]-2-cyano-N-phenethylacetamide IUPAC Name: (2E)-2-[(5S)-3-(4-bromophenyl)-5-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyano-N-phenethylacetamide Traditional Name: (2E)-2-[(5S)-3-(4-bromophenyl)-5-ethyl-4-keto-thiazolidin-2-ylidene]-2-cyano-N-phenethyl-acetamide Formula: C22H20BrN3O2S MolecularWeight: 470.3821

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C(=C(C#N)C(=O)NCCC2=CC=CC=C2)S1)C3=CC=C(C=C3)Br

Isomeric SMILES

CC[C@H]1C(=O)N(/C(=C(/C#N)\C(=O)NCCC2=CC=CC=C2)/S1)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H20BrN3O2S/c1-2-19-21(28)26(17-10-8-16(23)9-11-17)22(29-19)18(14-24)20(27)25-13-12-15-6-4-3-5-7-15/h3-11,19H,2,12-13H2,1H3,(H,25,27)/b22-18+/t19-/m0/s1