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Substance Name: Hydroxymethyl cimetidine
RN: 59359-50-1
InChIKey: JSTWNRREBFKXNZ-UHFFFAOYSA-N

Note

  • Blood metabolite of cimetidine.

Molecular Formula

  • C10-H16-N6-O-S

Molecular Weight

  • 268.343
 
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Names and Synonyms

Name of Substance

  • Hydroxymethyl cimetidine

Systematic Name

  • Guanidine, N-cyano-N'-(2-(((5-(hydroxymethyl)-1H-imidazol-4-yl)methyl)thio)ethyl)-N''-methyl-

Registry Numbers

CAS Registry Number

  • 59359-50-1

System Generated Number

  • 0059359501

Structure Descriptors

InChI

1S/C10H16N6OS/c1-12-10(14-6-11)13-2-3-18-5-9-8(4-17)15-7-16-9/h7,17H,2-5H2,1H3,(H,15,16)(H2,12,13,14)

InChIKey

JSTWNRREBFKXNZ-UHFFFAOYSA-N

Smiles

N(\C(NCCSCc1nc[nH]c1CO)=N\C)C#N