CAS: 1194550-67-8 - N-[[2-(6-Benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)-L-phenylalanine phenylmethyl ester

Formula: C₃₆H₃₀Cl₂N₂O₇S

InChI: InChI=1S/C36H30Cl2N2O7S/c1-48(44,45)27-9-5-8-23(16-27)17-30(36(43)47-21-22-6-3-2-4-7-22)39-34(41)32-29(37)18-26-20-40(14-12-28(26)33(32)38)35(42)25-11-10-24-13-15-46-31(24)19-25/h2-11,13,15-16,18-19,30H,12,14,17,20-21H2,1H3,(H,39,41)/t30-/m0/s1

InChI key: InChIKey=CWMBPRWSUXTRTQ-PMERELPUSA-N

SMILES: O=C(OCC=1C=CC=CC1)C(NC(=O)C2=C(Cl)C=C3C(=C2Cl)CCN(C(=O)C=4C=CC=5C=COC5C4)C3)CC6=CC=CC(=C6)S(=O)(=O)C

Synonyms:

• L-Phenylalanine, N-[[2-(6-benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)-, phenylmethyl ester
• Benzyl (S)-2-[[[2-[(benzofuran-6-yl)carbonyl]-5,7-dichloro-1,2,3,4-tetrahydroisoquinolin-6-yl]carbonyl]amino]-3-[3-(methylsulfonyl)phenyl]propanoate
• N-[[2-(6-Benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)-L-phenylalanine phenylmethyl ester

L-Phenylalanine, N-[[2-(6-benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)-, phenylmethyl ester

CAS: 1194550-67-8

• Formula: C₃₆H₃₀Cl₂N₂O₇S
• Purity: 98%
• Molecular weight: 705.6036

Lifitegrast Impurity 3

CAS: 1194550-67-8

• Formula: C₃₆H₃₀Cl₂N₂O₇S
• Color and Shape: Pale Orange Solid
• Molecular weight: 705.60

Benzyl (S)-2-(2-(benzofuran-6-carbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoate

CAS: 1194550-67-8

• Purity: 98%
• Molecular weight: 705.5999755859375

Benzyl (S)-2-(2-(benzofuran-6-carbonyl)-5,7-dichloro-1,2,3,4-tetrahydroi soquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoate

CAS: 1194550-67-8

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• Formula: C₃₆H₃₀Cl₂N₂O₇S
• Purity: Min. 95%
• Color and Shape: Powder
• Molecular weight: 705.6 g/mol