Thiazol-5-ylmethyl ((2S,3S,5S)-5-((S)-2-amino-3-methylbutanamido)-3-hydroxy-1,6-diphenylhexan-2-yl)carbamate, 98%

cas: 765875-58-9 — see every product listed under this CAS number, including other names

Thiazol-5-ylmethyl ((2S,3S,5S)-5-((S)-2-amino-3-methylbutanamido)-3-hydroxy-1,6-diphenylhexan-2-yl)carbamate, 98% (CAS 765875-58-9) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

• 2D
• 3D

1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-5-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-hydroxy-1,6-diphenylhexan-2-yl]carbamate (CAS 765875-58-9) is a chemical compound with the molecular formula C28H36N4O4S and a molecular weight of 524.7 g/mol. IUPAC name: 1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-5-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-hydroxy-1,6-diphenylhexan-2-yl]carbamate. InChIKey: JJZMZBZVLFGIEU-GKXKVECMSA-N.

Identity

Molecular formula	C28H36N4O4S
Molecular weight	524.7 g/mol
IUPAC name	1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-5-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-hydroxy-1,6-diphenylhexan-2-yl]carbamate
InChIKey	JJZMZBZVLFGIEU-GKXKVECMSA-N
SMILES	CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C[C@@H]([C@H](CC2=CC=CC=C2)NC(=O)OCC3=CN=CS3)O)N

Computed by PubChem (NCBI)

Synonyms: Ritonavir impurity B [EP], Des((2-isopropylthiazol-4-yl)methyl-methyl-carbamoyl)ritonavir, RITONAVIR IMPURITY B [EP IMPURITY], RITONAVIR IMPURITY B (EP IMPURITY), Ritonavir impurity, N-deacylvaline ritonavira-(USP), Ritonavir impurity, N-deacylvaline ritonavira-[USP], RITONAVIR IMPURITY, N-DEACYLVALINE RITONAVIRA-(USP IMPURITY), RITONAVIR IMPURITY, N-DEACYLVALINE RITONAVIRA-[USP IMPURITY], Ritonavir impurity B, Ritonavir EP Impurity B

Isomers (same molecular formula)

(1S,2R,6S,7R)-4-[[(1R,2R)-2-[[4-(1,1-dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]cyclohexyl]methyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione C₂₈H₃₆N₄O₄S

4-[[2-[[4-(1,1-dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]cyclohexyl]methyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione C₂₈H₃₆N₄O₄S

(2S,4R)-1-[(2S)-2-(hex-5-ynoylamino)-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide C₂₈H₃₆N₄O₄S