N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[(5-isopropyl-1H-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)C1=NC(=NN1)SCC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(C)C1=NC(=NN1)SCC(=O)NC2=C(C=C(C=C2)Br)F

InChI

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