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Substance Name: L 708714
RN: 161447-83-2
InChIKey: CXDLEXXONJAKQC-UHFFFAOYSA-N

Molecular Formula

  • C37-H28-I-N5-O5-S3

Molecular Weight

  • 845.7562
 
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Names and Synonyms

Name of Substance

  • L 708714

Synonym

  • L 708,714

Systematic Name

  • Benzoic acid, 2-(((1-((4-azido-3-iodophenyl)sulfonyl)-4,5-dihydro-4-methyl-6-((5-phenyl-2-pyridinyl)methoxy)-1H-thiopyrano(2,3,4-cd)indol-2-yl)methyl)thio)-

Registry Numbers

CAS Registry Number

  • 161447-83-2

System Generated Number

  • 0161447832

Structure Descriptors

InChI

1S/C37H28IN5O5S3/c1-22-17-28-33(48-20-25-12-11-24(19-40-25)23-7-3-2-4-8-23)16-15-31-35(28)36(50-22)32(21-49-34-10-6-5-9-27(34)37(44)45)43(31)51(46,47)26-13-14-30(41-42-39)29(38)18-26/h2-16,18-19,22H,17,20-21H2,1H3,(H,44,45)

InChIKey

CXDLEXXONJAKQC-UHFFFAOYSA-N

Smiles

CC1Cc2c(OCc3ccc(cn3)c4ccccc4)ccc5c2c(S1)c(CSc6ccccc6C(=O)O)n5S(=O)(=O)c7ccc(N=[N+]=[N-])c(I)c7