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Substance Name: NSC113226
RN: 50566-91-1
InChIKey: KERNTPPRHRQPNL-UHFFFAOYSA-N

Molecular Formula

  • C18-H19-F-N6-O3-S

Molecular Weight

  • 418.4511
 
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Names and Synonyms

Results Name

  • NSC113226

Synonym

  • NSC 113226

Systematic Name

  • Benzenesulfonyl fluoride, 4-((4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)benzoyl)amino)-

Registry Numbers

CAS Registry Number

  • 50566-91-1

System Generated Number

  • 0050566911

Structure Descriptors

InChI

1S/C18H19FN6O3S/c1-18(2)24-16(20)23-17(21)25(18)13-7-3-11(4-8-13)15(26)22-12-5-9-14(10-6-12)29(19,27)28/h3-10H,1-2H3,(H,22,26)(H4,20,21,23,24)

InChIKey

KERNTPPRHRQPNL-UHFFFAOYSA-N

Smiles

CC1(N=C(N=C(N1c2ccc(cc2)C(=O)Nc3ccc(cc3)S(=O)(=O)F)N)N)C