2-[(2-azanylpyridin-4-yl)methylsulfanyl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-[(2-azanylpyridin-4-yl)methylsulfanyl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Openeye Name: 2-[(2-amino-4-pyridyl)methylsulfanyl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide CAS Name: 2-[(2-amino-4-pyridinyl)methylthio]-N-[3-(trifluoromethyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-[(2-aminopyridin-4-yl)methylsulfanyl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Traditional Name: 2-[(2-amino-4-pyridyl)methylthio]-N-[3-(trifluoromethyl)phenyl]nicotinamide Formula: C19H15F3N4OS MolecularWeight: 404.40881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)N)C(F)(F)F

InChI

InChI=1S/C19H15F3N4OS/c20-19(21,22)13-3-1-4-14(10-13)26-17(27)15-5-2-7-25-18(15)28-11-12-6-8-24-16(23)9-12/h1-10H,11H2,(H2,23,24)(H,26,27)