Products 438200-34-1

CAS 438200-34-1 is the registry number for Saquinavir Hydroxy-tert-butylamide. Offered by: TRC. Available pack sizes: 100mg.

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

(2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-[(1-hydroxy-2-methylpropan-2-yl)carbamoyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide (CAS 438200-34-1) is a chemical compound with the molecular formula C38H50N6O6 and a molecular weight of 686.8 g/mol. IUPAC name: (2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-[(1-hydroxy-2-methylpropan-2-yl)carbamoyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide. InChIKey: SQCJGICLIMLWFB-UGJKXSETSA-N.

Identity
Molecular formulaC38H50N6O6
Molecular weight686.8 g/mol
IUPAC name(2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-[(1-hydroxy-2-methylpropan-2-yl)carbamoyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide
InChIKeySQCJGICLIMLWFB-UGJKXSETSA-N
SMILESCC(C)(CO)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@H]([C@H](CC3=CC=CC=C3)NC(=O)[C@H](CC(=O)N)NC(=O)C4=NC5=CC=CC=C5C=C4)O

Computed by PubChem (NCBI)