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

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C20H20F3N5OS MolecularWeight: 435.46591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C20H20F3N5OS/c1-19(2,3)15-11-16(28(27-15)13-7-5-4-6-8-13)26-17(29)12-30-18-24-10-9-14(25-18)20(21,22)23/h4-11H,12H2,1-3H3,(H,26,29)