Products 357189-96-9

CAS 357189-96-9 appears in our catalog under these names: Posaconazole Impurity 46, Posaconazole Impurity 79, Posaconazole Impurity 35, Posaconazole Impurity 223. Offered by: Chemat Brand, Hubei YoungXin. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg.

Structural formula: {0} (CAS {1})

N-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]-N-[2-[4-[1-[(2S,3S)-2-hydroxypentan-3-yl]-5-oxo-1,2,4-triazol-4-yl]anilino]ethyl]formamide (CAS 357189-96-9) is a chemical compound with the molecular formula C36H40F2N8O5 and a molecular weight of 702.7 g/mol. IUPAC name: N-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]-N-[2-[4-[1-[(2S,3S)-2-hydroxypentan-3-yl]-5-oxo-1,2,4-triazol-4-yl]anilino]ethyl]formamide. InChIKey: CAWXPFQHAJHELH-YUYQYMTJSA-N.

Identity
Molecular formulaC36H40F2N8O5
Molecular weight702.7 g/mol
IUPAC nameN-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]-N-[2-[4-[1-[(2S,3S)-2-hydroxypentan-3-yl]-5-oxo-1,2,4-triazol-4-yl]anilino]ethyl]formamide
InChIKeyCAWXPFQHAJHELH-YUYQYMTJSA-N
SMILESCC[C@@H]([C@H](C)O)N1C(=O)N(C=N1)C2=CC=C(C=C2)NCCN(C=O)C3=CC=C(C=C3)OC[C@H]4C[C@](OC4)(CN5C=NC=N5)C6=C(C=C(C=C6)F)F

Computed by PubChem (NCBI)