2-[[2-cyano-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]benzamide

Systemtic Name: 2-[[2-cyano-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]benzamide Openeye Name: 2-[[2-cyano-2-[4-(2,4-dimethylphenyl)thiazol-2-yl]vinyl]amino]benzamide CAS Name: 2-[[2-cyano-2-[4-(2,4-dimethylphenyl)-2-thiazolyl]ethenyl]amino]benzamide IUPAC Name: 2-[[2-cyano-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]benzamide Traditional Name: 2-[[2-cyano-2-[4-(2,4-dimethylphenyl)thiazol-2-yl]vinyl]amino]benzamide Formula: C21H18N4OS MolecularWeight: 374.45882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=CC=C3C(=O)N)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=CC=C3C(=O)N)C#N)C

InChI

InChI=1S/C21H18N4OS/c1-13-7-8-16(14(2)9-13)19-12-27-21(25-19)15(10-22)11-24-18-6-4-3-5-17(18)20(23)26/h3-9,11-12,24H,1-2H3,(H2,23,26)