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Substance Name: Batefenterol [USAN:INN]
RN: 743461-65-6
UNII: 1IAT42T80T
InChIKey: URWYQGVSPQJGGB-DHUJRADRSA-N

Classification Code

  • Treatment of Chronic Obstructive Pulmonary

Molecular Formula

  • C40-H42-Cl-N5-O7

Molecular Weight

  • 740.2528
 
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Names and Synonyms

Name of Substance

  • Batefenterol [USAN:INN]

Synonyms

  • 1-(3-((2-Chloro-4-((((2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl)amino)methyl)-5-methoxyphenyl)amino)-3-oxopropyl)piperidin-4-yl (biphenyl-2-yl)carbamate
  • Batefenterol
  • GSK961081A
  • UNII-1IAT42T80T

Systematic Name

  • Carbamic acid, N-(1,1'-biphenyl)-2-yl-, 1-(3-((2-chloro-4-((((2R)-2-(1,2-dihydro-8-hydroxy-2-oxo-5-quinolinyl)-2-hydroxyethyl)amino)methyl)-5-methoxyphenyl)amino)-3-oxopropyl)-4-piperidinyl ester

Registry Numbers

CAS Registry Number

  • 743461-65-6

FDA UNII

  • 1IAT42T80T

System Generated Number

  • 0743461656

Structure Descriptors

InChI

1S/C40H42ClN5O7/c1-52-36-22-33(31(41)21-26(36)23-42-24-35(48)29-11-13-34(47)39-30(29)12-14-37(49)45-39)43-38(50)17-20-46-18-15-27(16-19-46)53-40(51)44-32-10-6-5-9-28(32)25-7-3-2-4-8-25/h2-14,21-22,27,35,42,47-48H,15-20,23-24H2,1H3,(H,43,50)(H,44,51)(H,45,49)/t35-/m0/s1

InChIKey

URWYQGVSPQJGGB-DHUJRADRSA-N

Smiles

COc1cc(c(cc1CNC[C@@H](c2ccc(c3c2ccc(=O)[nH]3)O)O)Cl)NC(=O)CCN4CCC(CC4)OC(=O)Nc5ccccc5c6ccccc6