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

Systemtic Name: (E)-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (E)-3-[2-(4-chlorophenyl)thiazol-4-yl]-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (E)-3-[2-(4-chlorophenyl)-4-thiazolyl]-2-cyano-N-phenethyl-2-propenamide IUPAC Name: (E)-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyano-N-phenethylprop-2-enamide Traditional Name: (E)-3-[2-(4-chlorophenyl)thiazol-4-yl]-2-cyano-N-phenethyl-acrylamide Formula: C21H16ClN3OS MolecularWeight: 393.88924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(=CC2=CSC(=N2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)/C(=C/C2=CSC(=N2)C3=CC=C(C=C3)Cl)/C#N

InChI

InChI=1S/C21H16ClN3OS/c22-18-8-6-16(7-9-18)21-25-19(14-27-21)12-17(13-23)20(26)24-11-10-15-4-2-1-3-5-15/h1-9,12,14H,10-11H2,(H,24,26)/b17-12+