5-[[4-(4-ethanoylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-furan-2-carboxamide

Systemtic Name: 5-[[4-(4-ethanoylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-furan-2-carboxamide Openeye Name: 5-[[4-(4-acetylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-N-isopropyl-furan-2-carboxamide CAS Name: 5-[[[4-(4-acetyl-1-piperazinyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-N-propan-2-yl-2-furancarboxamide IUPAC Name: 5-[[4-(4-acetylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-ylfuran-2-carboxamide Traditional Name: 5-[[[4-(4-acetylpiperazino)-6-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]-N-isopropyl-2-furamide Formula: C20H24F3N5O3S MolecularWeight: 471.49647

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=C(O1)CSC2=NC(=CC(=N2)N3CCN(CC3)C(=O)C)C(F)(F)F

Isomeric SMILES

CC(C)NC(=O)C1=CC=C(O1)CSC2=NC(=CC(=N2)N3CCN(CC3)C(=O)C)C(F)(F)F

InChI

InChI=1S/C20H24F3N5O3S/c1-12(2)24-18(30)15-5-4-14(31-15)11-32-19-25-16(20(21,22)23)10-17(26-19)28-8-6-27(7-9-28)13(3)29/h4-5,10,12H,6-9,11H2,1-3H3,(H,24,30)