N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C13H14BrFN4OS MolecularWeight: 373.243863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(C)N1C=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H14BrFN4OS/c1-8(2)19-7-16-18-13(19)21-6-12(20)17-11-4-3-9(14)5-10(11)15/h3-5,7-8H,6H2,1-2H3,(H,17,20)