N-tert-butyl-4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butanamide

Systemtic Name: N-tert-butyl-4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butanamide Openeye Name: N-tert-butyl-4-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butanamide CAS Name: N-tert-butyl-4-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]butanamide IUPAC Name: N-tert-butyl-4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylbutanamide Traditional Name: N-tert-butyl-4-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]butyramide Formula: C17H20F3N3O2S MolecularWeight: 387.41981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CCCSC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CO2

Isomeric SMILES

CC(C)(C)NC(=O)CCCSC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CO2

InChI

InChI=1S/C17H20F3N3O2S/c1-16(2,3)23-14(24)7-5-9-26-15-21-11(12-6-4-8-25-12)10-13(22-15)17(18,19)20/h4,6,8,10H,5,7,9H2,1-3H3,(H,23,24)