Lifitegrast, (R)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H24Cl2N2O7S
Molecular Weight	615.481
Optical Activity	( + )
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS(=O)(=O)C1=CC=CC(C[C@@H](NC(=O)C2=C(Cl)C=C3CN(CCC3=C2Cl)C(=O)C4=CC=C5C=COC5=C4)C(O)=O)=C1

InChI

InChIKey=JFOZKMSJYSPYLN-HSZRJFAPSA-N

InChI=1S/C29H24Cl2N2O7S/c1-41(38,39)20-4-2-3-16(11-20)12-23(29(36)37)32-27(34)25-22(30)13-19-15-33(9-7-21(19)26(25)31)28(35)18-6-5-17-8-10-40-24(17)14-18/h2-6,8,10-11,13-14,23H,7,9,12,15H2,1H3,(H,32,34)(H,36,37)/t23-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Lifitegrast, (R)-

Common Name

English

N-[[2-(6-Benzofuranylcarbonyl)-5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl]carbonyl]-3-(methylsulfonyl)-D-phenylalanine

Common Name

English

(2S)-2-[[2-(1-Benzofuran-6-carbonyl)-5,7-dichloro-3,4-dihydro-1h-isoquinoline-6-carbonyl]amino]-3-(3-methylsulfonylphenyl)propanoic acid

Systematic Name

English

R-Lifitegrast

Common Name

English

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

Common Name

English

Lifitegrast Impurity 8

Common Name

English

Code System Code Type Description

PUBCHEM

129626566

Created by admin on Sat Dec 16 19:15:44 GMT 2023 , Edited by admin on Sat Dec 16 19:15:44 GMT 2023

PRIMARY

FDA UNII

Q8VE5H5V6Z

Created by admin on Sat Dec 16 19:15:44 GMT 2023 , Edited by admin on Sat Dec 16 19:15:44 GMT 2023

PRIMARY

CAS

2271299-08-0

Created by admin on Sat Dec 16 19:15:44 GMT 2023 , Edited by admin on Sat Dec 16 19:15:44 GMT 2023

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SUBSTANCE RECORD


					Q8VE5H5V6Z

Lifitegrast, (R)-