4-methyl-2-phenyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 4-methyl-2-phenyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1,3-thiazole-5-carboxamide Openeye Name: 4-methyl-2-phenyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]thiazole-5-carboxamide CAS Name: 4-methyl-2-phenyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-5-thiazolecarboxamide IUPAC Name: 4-methyl-2-phenyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1,3-thiazole-5-carboxamide Traditional Name: 4-methyl-2-phenyl-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]thiazole-5-carboxamide Formula: C21H15F3N2OS MolecularWeight: 400.41681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NCC#CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NCC#CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H15F3N2OS/c1-14-18(28-20(26-14)16-9-3-2-4-10-16)19(27)25-12-6-8-15-7-5-11-17(13-15)21(22,23)24/h2-5,7,9-11,13H,12H2,1H3,(H,25,27)