N-(4-bromanyl-2-fluoranyl-phenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3-[2-(2-pyridyl)ethylsulfanyl]propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-[2-(2-pyridinyl)ethylthio]propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-3-[2-(2-pyridyl)ethylthio]propionamide Formula: C16H16BrFN2OS MolecularWeight: 383.278443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCSCCC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1=CC=NC(=C1)CCSCCC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H16BrFN2OS/c17-12-4-5-15(14(18)11-12)20-16(21)7-10-22-9-6-13-3-1-2-8-19-13/h1-5,8,11H,6-7,9-10H2,(H,20,21)