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Substance Name: SQ 28853
RN: 107550-68-5
InChIKey: GCQIUSPLZKYQEO-ZUEGONOJSA-M

Molecular Weight

  • 559.0616
 
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Names and Synonyms

Name of Substance

  • SQ 28853

Synonyms

  • 4-(2-(6-(Aminosulfonyl)-7-chloro-1,2,3,4-tetrahydro-4-oxo-2-quinazolinyl)ethyl)thiol-1-(3-mercapto-2-methyl-1-oxopropyl)proline
  • SQ-28853

Systematic Name

  • L-Proline, 4-((2-(6-(aminosulfonyl)-7-chloro-1,2,3,4-tetrahydro-4-oxo-2-quinazolinyl)ethyl)thio)-1-(3-mercapto-2-methyl-1-oxopropyl)-, monosodium salt, (1(R*),2alpha,4alpha)-

Registry Numbers

CAS Registry Number

  • 107550-68-5

System Generated Number

  • 0107550685

Structure Descriptors

InChI

1S/C19H25ClN4O6S3.Na/c1-9(8-31)18(26)24-7-10(4-14(24)19(27)28)32-3-2-16-22-13-6-12(20)15(33(21,29)30)5-11(13)17(25)23-16;/h5-6,9-10,14,16,22,31H,2-4,7-8H2,1H3,(H,23,25)(H,27,28)(H2,21,29,30);/q;+1/p-1/t9-,10+,14+,16?;/m1./s1

InChIKey

GCQIUSPLZKYQEO-ZUEGONOJSA-M

Smiles

C[C@H](CS)C(=O)N1C[C@H](C[C@H]1C(=O)[O-])SCCC2Nc3cc(c(cc3C(=O)N2)S(=O)(=O)N)Cl.[Na+]