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

Systemtic Name: N-cycloheptyl-4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butanamide Openeye Name: N-cycloheptyl-4-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butanamide CAS Name: N-cycloheptyl-4-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]butanamide IUPAC Name: N-cycloheptyl-4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylbutanamide Traditional Name: N-cycloheptyl-4-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]butyramide Formula: C20H24F3N3O2S MolecularWeight: 427.48367

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CCCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

C1CCCC(CC1)NC(=O)CCCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C20H24F3N3O2S/c21-20(22,23)17-13-15(16-9-5-11-28-16)25-19(26-17)29-12-6-10-18(27)24-14-7-3-1-2-4-8-14/h5,9,11,13-14H,1-4,6-8,10,12H2,(H,24,27)