ethyl 2-[3-(4-bromophenyl)-5-phenyl-1,3-thiazol-2-ylidene]-2-cyano-ethanoate

Systemtic Name: ethyl 2-[3-(4-bromophenyl)-5-phenyl-1,3-thiazol-2-ylidene]-2-cyano-ethanoate Openeye Name: ethyl 2-[3-(4-bromophenyl)-5-phenyl-thiazol-2-ylidene]-2-cyano-acetate CAS Name: 2-[3-(4-bromophenyl)-5-phenyl-2-thiazolylidene]-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-bromophenyl)-5-phenyl-1,3-thiazol-2-ylidene]-2-cyanoacetate Traditional Name: 2-[3-(4-bromophenyl)-5-phenyl-4-thiazolin-2-ylidene]-2-cyano-acetic acid ethyl ester Formula: C20H15BrN2O2S MolecularWeight: 427.3143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1N(C=C(S1)C2=CC=CC=C2)C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

CCOC(=O)C(=C1N(C=C(S1)C2=CC=CC=C2)C3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C20H15BrN2O2S/c1-2-25-20(24)17(12-22)19-23(16-10-8-15(21)9-11-16)13-18(26-19)14-6-4-3-5-7-14/h3-11,13H,2H2,1H3