2-[(2-morpholin-4-ylpyrimidin-4-yl)methylsulfanyl]-N-[4-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-[(2-morpholin-4-ylpyrimidin-4-yl)methylsulfanyl]-N-[4-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide Openeye Name: 2-[(2-morpholinopyrimidin-4-yl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide CAS Name: 2-[[2-(4-morpholinyl)-4-pyrimidinyl]methylthio]-N-[4-(trifluoromethoxy)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-[(2-morpholin-4-ylpyrimidin-4-yl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide Traditional Name: 2-[(2-morpholinopyrimidin-4-yl)methylthio]-N-[4-(trifluoromethoxy)phenyl]nicotinamide Formula: C22H20F3N5O3S MolecularWeight: 491.48611

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=CC(=N2)CSC3=C(C=CC=N3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1COCCN1C2=NC=CC(=N2)CSC3=C(C=CC=N3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C22H20F3N5O3S/c23-22(24,25)33-17-5-3-15(4-6-17)28-19(31)18-2-1-8-26-20(18)34-14-16-7-9-27-21(29-16)30-10-12-32-13-11-30/h1-9H,10-14H2,(H,28,31)