(2E)-2-[4-(4-bromophenyl)-3-(phenylmethyl)-1,3-thiazol-2-ylidene]-2-cyano-ethanamide

Systemtic Name: (2E)-2-[4-(4-bromophenyl)-3-(phenylmethyl)-1,3-thiazol-2-ylidene]-2-cyano-ethanamide Openeye Name: (2E)-2-[3-benzyl-4-(4-bromophenyl)thiazol-2-ylidene]-2-cyano-acetamide CAS Name: (2E)-2-[4-(4-bromophenyl)-3-(phenylmethyl)-2-thiazolylidene]-2-cyanoacetamide IUPAC Name: (2E)-2-[3-benzyl-4-(4-bromophenyl)-1,3-thiazol-2-ylidene]-2-cyanoacetamide Traditional Name: (2E)-2-[3-benzyl-4-(4-bromophenyl)-4-thiazolin-2-ylidene]-2-cyano-acetamide Formula: C19H14BrN3OS MolecularWeight: 412.30296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CSC2=C(C#N)C(=O)N)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CN\2C(=CS/C2=C(\C#N)/C(=O)N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H14BrN3OS/c20-15-8-6-14(7-9-15)17-12-25-19(16(10-21)18(22)24)23(17)11-13-4-2-1-3-5-13/h1-9,12H,11H2,(H2,22,24)/b19-16+