(E)-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-dimethylaminophenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-dimethylaminophenyl)prop-2-enamide Openeye Name: (E)-N-[4-(4-bromophenyl)thiazol-2-yl]-2-cyano-3-(4-dimethylaminophenyl)prop-2-enamide CAS Name: (E)-N-[4-(4-bromophenyl)-2-thiazolyl]-2-cyano-3-(4-dimethylaminophenyl)-2-propenamide IUPAC Name: (E)-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-dimethylaminophenyl)prop-2-enamide Traditional Name: (E)-N-[4-(4-bromophenyl)thiazol-2-yl]-2-cyano-3-(4-dimethylaminophenyl)acrylamide Formula: C21H17BrN4OS MolecularWeight: 453.35488

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H17BrN4OS/c1-26(2)18-9-3-14(4-10-18)11-16(12-23)20(27)25-21-24-19(13-28-21)15-5-7-17(22)8-6-15/h3-11,13H,1-2H3,(H,24,25,27)/b16-11+