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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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