4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-pyridin-3-yl-butanamide

Systemtic Name: 4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-pyridin-3-yl-butanamide Openeye Name: 4-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(3-pyridyl)butanamide CAS Name: 4-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-(3-pyridinyl)butanamide IUPAC Name: 4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-pyridin-3-ylbutanamide Traditional Name: 4-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]-N-(3-pyridyl)butyramide Formula: C18H15F3N4O2S MolecularWeight: 408.39751

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15F3N4O2S/c19-18(20,21)15-10-13(14-5-2-8-27-14)24-17(25-15)28-9-3-6-16(26)23-12-4-1-7-22-11-12/h1-2,4-5,7-8,10-11H,3,6,9H2,(H,23,26)