4-[4-cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylbutanoic acid

Systemtic Name: 4-[4-cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylbutanoic acid Openeye Name: 4-[4-cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylbutanoic acid CAS Name: 4-[[4-cyclopropyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]butanoic acid IUPAC Name: 4-[4-cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylbutanoic acid Traditional Name: 4-[[4-cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]butyric acid Formula: C12H13F3N2O2S MolecularWeight: 306.30403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NC(=N2)SCCCC(=O)O)C(F)(F)F

Isomeric SMILES

C1CC1C2=CC(=NC(=N2)SCCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C12H13F3N2O2S/c13-12(14,15)9-6-8(7-3-4-7)16-11(17-9)20-5-1-2-10(18)19/h6-7H,1-5H2,(H,18,19)