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

Systemtic Name: 2-[(2-acetamidopyrimidin-4-yl)methylsulfanyl]-N-[4-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide Openeye Name: 2-[(2-acetamidopyrimidin-4-yl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide CAS Name: 2-[(2-acetamido-4-pyrimidinyl)methylthio]-N-[4-(trifluoromethoxy)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-[(2-acetamidopyrimidin-4-yl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide Traditional Name: 2-[(2-acetamidopyrimidin-4-yl)methylthio]-N-[4-(trifluoromethoxy)phenyl]nicotinamide Formula: C20H16F3N5O3S MolecularWeight: 463.43295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=N1)CSC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(=O)NC1=NC=CC(=N1)CSC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C20H16F3N5O3S/c1-12(29)26-19-25-10-8-14(28-19)11-32-18-16(3-2-9-24-18)17(30)27-13-4-6-15(7-5-13)31-20(21,22)23/h2-10H,11H2,1H3,(H,27,30)(H,25,26,28,29)