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

Systemtic Name: N-(4-ethoxyphenyl)-4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butanamide Openeye Name: N-(4-ethoxyphenyl)-4-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butanamide CAS Name: N-(4-ethoxyphenyl)-4-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]butanamide IUPAC Name: N-(4-ethoxyphenyl)-4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylbutanamide Traditional Name: 4-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]-N-p-phenetyl-butyramide Formula: C21H20F3N3O3S MolecularWeight: 451.46201

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C21H20F3N3O3S/c1-2-29-15-9-7-14(8-10-15)25-19(28)6-4-12-31-20-26-16(17-5-3-11-30-17)13-18(27-20)21(22,23)24/h3,5,7-11,13H,2,4,6,12H2,1H3,(H,25,28)