| Identification | Back Directory | [Name]
Isavuconazole intermediate | [CAS]
1286730-01-5 | [Synonyms]
(3S,4R,5S)-3,4,5,6-Tetrahydroxy-2-Keto-Hexanoic Acid
(2R,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)thiobutyramide sulfate | [EINECS(EC#)]
-0 | [Molecular Formula]
C13H16F2N4O5S2 | [MDL Number]
MFCD30738027 | [MOL File]
1286730-01-5.mol | [Molecular Weight]
410.41 |
| Chemical Properties | Back Directory | [InChI]
InChI=1/C13H14F2N4OS.H2O4S/c1-8(12(16)21)13(20,5-19-7-17-6-18-19)10-4-9(14)2-3-11(10)15;1-5(2,3)4/h2-4,6-8,20H,5H2,1H3,(H2,16,21);(H2,1,2,3,4)/t8-,13+;/s3 | [InChIKey]
XGRIDCNJIYGKHE-USQBSZIENA-N | [SMILES]
S(O)(O)(=O)=O.[C@](C1C=C(F)C=CC=1F)(O)([C@@H](C)C(=S)N)CN1N=CN=C1 |&1:5,15,r| |
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