N-(5-cyclopentyl-2-phenyl-pyrazol-3-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-cyclopentyl-2-phenyl-pyrazol-3-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(5-cyclopentyl-2-phenyl-pyrazol-3-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(5-cyclopentyl-2-phenyl-3-pyrazolyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(5-cyclopentyl-2-phenylpyrazol-3-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(5-cyclopentyl-2-phenyl-pyrazol-3-yl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C21H20F3N5OS MolecularWeight: 447.47661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NN(C(=C2)NC(=O)CSC3=NC=CC(=N3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)C2=NN(C(=C2)NC(=O)CSC3=NC=CC(=N3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C21H20F3N5OS/c22-21(23,24)17-10-11-25-20(26-17)31-13-19(30)27-18-12-16(14-6-4-5-7-14)28-29(18)15-8-2-1-3-9-15/h1-3,8-12,14H,4-7,13H2,(H,27,30)