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

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C12H12BrFN4OS MolecularWeight: 359.217283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Br)F)SC2=NN=CN2C

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Br)F)SC2=NN=CN2C

InChI

InChI=1S/C12H12BrFN4OS/c1-7(20-12-17-15-6-18(12)2)11(19)16-10-4-3-8(13)5-9(10)14/h3-7H,1-2H3,(H,16,19)