2-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-[4-(trifluoromethyloxy)phenyl]benzamide

Systemtic Name: 2-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-[4-(trifluoromethyloxy)phenyl]benzamide Openeye Name: 2-[(2-acetamido-4-pyridyl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]benzamide CAS Name: 2-[(2-acetamido-4-pyridinyl)methylthio]-N-[4-(trifluoromethoxy)phenyl]benzamide IUPAC Name: 2-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]benzamide Traditional Name: 2-[(2-acetamido-4-pyridyl)methylthio]-N-[4-(trifluoromethoxy)phenyl]benzamide Formula: C22H18F3N3O3S MolecularWeight: 461.45683

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=C1)CSC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(=O)NC1=NC=CC(=C1)CSC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C22H18F3N3O3S/c1-14(29)27-20-12-15(10-11-26-20)13-32-19-5-3-2-4-18(19)21(30)28-16-6-8-17(9-7-16)31-22(23,24)25/h2-12H,13H2,1H3,(H,28,30)(H,26,27,29)