N-(2-morpholin-4-ylethyl)-5-[[4-pyrrolidin-1-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-5-[[4-pyrrolidin-1-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide Openeye Name: N-(2-morpholinoethyl)-5-[[4-pyrrolidin-1-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide CAS Name: N-[2-(4-morpholinyl)ethyl]-5-[[[4-(1-pyrrolidinyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-2-furancarboxamide IUPAC Name: N-(2-morpholin-4-ylethyl)-5-[[4-pyrrolidin-1-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide Traditional Name: N-(2-morpholinoethyl)-5-[[[4-pyrrolidino-6-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]-2-furamide Formula: C21H26F3N5O3S MolecularWeight: 485.52305

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC(=C2)C(F)(F)F)SCC3=CC=C(O3)C(=O)NCCN4CCOCC4

Isomeric SMILES

C1CCN(C1)C2=NC(=NC(=C2)C(F)(F)F)SCC3=CC=C(O3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C21H26F3N5O3S/c22-21(23,24)17-13-18(29-6-1-2-7-29)27-20(26-17)33-14-15-3-4-16(32-15)19(30)25-5-8-28-9-11-31-12-10-28/h3-4,13H,1-2,5-12,14H2,(H,25,30)