2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C17H16F3N5OS MolecularWeight: 395.40205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C17H16F3N5OS/c1-9-14(10(2)25(3)24-9)22-13(26)8-27-15-11-6-4-5-7-12(11)21-16(23-15)17(18,19)20/h4-7H,8H2,1-3H3,(H,22,26)