2-[(2-morpholin-4-ylethanoylamino)-pyridin-4-yl-methyl]sulfanyl-N-[4-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-[(2-morpholin-4-ylethanoylamino)-pyridin-4-yl-methyl]sulfanyl-N-[4-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide Openeye Name: 2-[[(2-morpholinoacetyl)amino]-(4-pyridyl)methyl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide CAS Name: 2-[[[[2-(4-morpholinyl)-1-oxoethyl]amino]-pyridin-4-ylmethyl]thio]-N-[4-(trifluoromethoxy)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-[[(2-morpholin-4-ylacetyl)amino]-pyridin-4-ylmethyl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide Traditional Name: 2-[[[(2-morpholinoacetyl)amino]-(4-pyridyl)methyl]thio]-N-[4-(trifluoromethoxy)phenyl]nicotinamide Formula: C25H24F3N5O4S MolecularWeight: 547.54937

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC(=O)NC(C2=CC=NC=C2)SC3=C(C=CC=N3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1COCCN1CC(=O)NC(C2=CC=NC=C2)SC3=C(C=CC=N3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C25H24F3N5O4S/c26-25(27,28)37-19-5-3-18(4-6-19)31-22(35)20-2-1-9-30-24(20)38-23(17-7-10-29-11-8-17)32-21(34)16-33-12-14-36-15-13-33/h1-11,23H,12-16H2,(H,31,35)(H,32,34)