CAS: 368421-58-3 - (2R,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)butanethioamide

Formula: C₁₃H₁₄F₂N₄OS

InChI: InChI=1S/C13H14F2N4OS/c1-8(12(16)21)13(20,5-19-7-17-6-18-19)10-4-9(14)2-3-11(10)15/h2-4,6-8,20H,5H2,1H3,(H2,16,21)/t8-,13+/m0/s1

InChI key: InChIKey=UWVOPVUWKIHGRF-ISVAXAHUSA-N

SMILES: FC1=CC=C(F)C(=C1)C(O)(CN2N=CN=C2)C(C(=S)N)C

Synonyms:

• (2R,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)thiobutyramide
• (αR,βR)-β-(2,5-Difluorophenyl)-β-hydroxy-α-methyl-1H-1,2,4-triazole-1-butanethioamide
• 1H-1,2,4-Triazole-1-butanethioamide, β-(2,5-difluorophenyl)-β-hydroxy-α-methyl-, (αR,βR)-

(2R,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-2-Methyl-4-(1H-1,2,4-triazol-1-yl)thiobutyraMide

CAS: 368421-58-3

• Formula: C₁₃H₁₄F₂N₄OS
• Purity: 98%
• Color and Shape: Solid
• Molecular weight: 312.3383

Isavuconazole Impurity 36

CAS: 368421-58-3

• Formula: C₁₃H₁₄F₂N₄OS
• Molecular weight: 312.34

(2R,3R)-3-(2,5-DIFLUOROPHENYL)-3-HYDROXY-2-METHYL-4-(1H-1,2,4-TRIAZOL-1-YL)BUTANETHIOAMIDE

CAS: 368421-58-3

• Purity: 97.0%
• Molecular weight: 312.3399963378906

(2S,3S)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)butanethioamide

CAS: 368421-58-3

• Formula: C₁₃H₁₄F₂N₄OS
• Color and Shape: Neat
• Molecular weight: 312.338

(2R,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)thiobutyramide

CAS: 368421-58-3

• Formula: C₁₃H₁₄F₂N₄OS
• Color and Shape: Neat
• Molecular weight: 312.34

(2R,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)thiobutyramide sulfate

CAS: 368421-58-3

Intermediate in the synthesis of isavuconazonium

• Formula: C₁₃H₁₄F₂N₄OS
• Purity: Min. 95%
• Molecular weight: 312.34 g/mol