N-cyclohexyl-3-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-cyclohexyl-3-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: N-cyclohexyl-3-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-cyclohexyl-3-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide IUPAC Name: N-cyclohexyl-3-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-cyclohexyl-3-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]propionamide Formula: C18H20F3N3O2S MolecularWeight: 399.43051

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

C1CCC(CC1)NC(=O)CCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C18H20F3N3O2S/c19-18(20,21)15-11-13(14-7-4-9-26-14)23-17(24-15)27-10-8-16(25)22-12-5-2-1-3-6-12/h4,7,9,11-12H,1-3,5-6,8,10H2,(H,22,25)