1-((2R,3R)-3-(4-(4-Cyanophenyl)thiazol-2-yl)-2-(2,5-difluorophenyl)-2-hydroxybutyl)-4-(1-((methyl(3-(((methylglycyl)oxy)methyl)pyridin-2-yl)carbamoyl)oxy)ethyl)-1H-1,2,4-triazol-4-ium hydrogen sulfate, 98%

cas: 946075-13-4 — see every product listed under this CAS number, including other names

1-((2R,3R)-3-(4-(4-Cyanophenyl)thiazol-2-yl)-2-(2,5-difluorophenyl)-2-hydroxybutyl)-4-(1-((methyl(3-(((methylglycyl)oxy)methyl)pyridin-2-yl)carbamoyl)oxy)ethyl)-1H-1,2,4-triazol-4-ium hydrogen sulfate, 98% (CAS 946075-13-4) is a chemical reagent available from Chemat. Available pack sizes: 50mg, 100mg, 250mg, 1g, 5g. Offered by: BLDpharm.

• 2D
• 3D

Isavuconazonium sulfate is an azaheterocycle sulfate salt that is a prodrug for isavuconazole, an antifungal agent used for the treatment of invasive aspergillosis and invasive mucormycosis. It has a role as a prodrug, an orphan drug, an ergosterol biosynthesis inhibitor and an EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor. It is an azaheterocycle sulfate salt, a conazole antifungal drug and a triazole antifungal drug. It contains an isavuconazonium.

Source: ChEBI

Identity

Molecular formula	C35H36F2N8O9S2
Molecular weight	814.8 g/mol
IUPAC name	[2-[1-[1-[(2R,3R)-3-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-2-(2,5-difluorophenyl)-2-hydroxybutyl]-1,2,4-triazol-4-ium-4-yl]ethoxycarbonyl-methylamino]-3-pyridinyl]methyl 2-(methylamino)acetate;hydrogen sulfate
InChIKey	LWXUIUUOMSMZKJ-KLFWAVJMSA-M
SMILES	C[C@@H](C1=NC(=CS1)C2=CC=C(C=C2)C#N)[C@](CN3C=[N+](C=N3)C(C)OC(=O)N(C)C4=C(C=CC=N4)COC(=O)CNC)(C5=C(C=CC(=C5)F)F)O.OS(=O)(=O)[O-]

Computed by PubChem (NCBI)

Synonyms: Isavuconazonium sulfate, Cresemba, Isavuconazonium (sulfate), Isavuconazonium sulfate [USAN], Glycine, N-methyl-, (2-(, orb1222974, orb1303543, Isavuconazonium sulfate (JAN/USAN), ISAVUCONAZONIUM SULFATE [JAN], ISAVUCONAZONIUM SULFATE [WHO-DD]