morpholin-4-yl-[2-phenyl-4-[3-(trifluoromethyl)phenyl]sulfanyl-pyrimidin-5-yl]methanone

Systemtic Name: morpholin-4-yl-[2-phenyl-4-[3-(trifluoromethyl)phenyl]sulfanyl-pyrimidin-5-yl]methanone Openeye Name: morpholino-[2-phenyl-4-[3-(trifluoromethyl)phenyl]sulfanyl-pyrimidin-5-yl]methanone CAS Name: 4-morpholinyl-[2-phenyl-4-[[3-(trifluoromethyl)phenyl]thio]-5-pyrimidinyl]methanone IUPAC Name: morpholin-4-yl-[2-phenyl-4-[3-(trifluoromethyl)phenyl]sulfanylpyrimidin-5-yl]methanone Traditional Name: morpholino-[2-phenyl-4-[[3-(trifluoromethyl)phenyl]thio]pyrimidin-5-yl]methanone Formula: C22H18F3N3O2S MolecularWeight: 445.45743

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CN=C(N=C2SC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C(=O)C2=CN=C(N=C2SC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C22H18F3N3O2S/c23-22(24,25)16-7-4-8-17(13-16)31-20-18(21(29)28-9-11-30-12-10-28)14-26-19(27-20)15-5-2-1-3-6-15/h1-8,13-14H,9-12H2