CAS: 1194550-61-2 - 1,1-Dimethylethyl 5,7-dichloro-3,4-dihydro-6-[[[(1S)-1-[[3-(methylsulfonyl)phenyl]methyl]-2-oxo-2-(phenylmethoxy)ethyl]amino]carbonyl]-2(1H)-isoquinolinecarboxylate

Formule : C₃₂H₃₄Cl₂N₂O₇S

InChI : InChI=1S/C32H34Cl2N2O7S/c1-32(2,3)43-31(39)36-14-13-24-22(18-36)17-25(33)27(28(24)34)29(37)35-26(30(38)42-19-20-9-6-5-7-10-20)16-21-11-8-12-23(15-21)44(4,40)41/h5-12,15,17,26H,13-14,16,18-19H2,1-4H3,(H,35,37)/t26-/m0/s1

Code InChI : InChIKey=ZTYYSZJSTXFVKI-SANMLTNESA-N

SMILES : O=C(OC(C)(C)C)N1CC2=CC(Cl)=C(C(=O)NC(C(=O)OCC=3C=CC=CC3)CC4=CC=CC(=C4)S(=O)(=O)C)C(Cl)=C2CC1

Synonymes :

• 1,1-Dimethylethyl 5,7-dichloro-3,4-dihydro-6-[[[(1S)-1-[[3-(methylsulfonyl)phenyl]methyl]-2-oxo-2-(phenylmethoxy)ethyl]amino]carbonyl]-2(1H)-isoquinolinecarboxylate
• Benzyl (S)-2-[[[2-(tert-butoxycarbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinolin-6-yl]carbonyl]amino]-3-[3-(methylsulfonyl)phenyl]propanoate
• 2(1H)-Isoquinolinecarboxylic acid, 5,7-dichloro-3,4-dihydro-6-[[[(1S)-1-[[3-(methylsulfonyl)phenyl]methyl]-2-oxo-2-(phenylmethoxy)ethyl]amino]carbonyl]-, 1,1-dimethylethyl ester

Lifitegrast Impurity 1

CAS : 1194550-61-2

• Formule : C₃₂H₃₄Cl₂N₂O₇S
• Masse moléculaire : 661.59