Cimetidine sulfoxide

CAS Registry Number®

54237-72-8

CAS Name

Cimetidine sulfoxide

Molecular Formula

C10H16N6OS

Molecular Mass

268.34

Cite this Page

Cimetidine sulfoxide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54237-72-8 (retrieved 2024-11-22) (CAS RN: 54237-72-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H16N6OS/c1-8-9(16-7-15-8)5-18(17)4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)

InChIKey

InChIKey=HOJLJLYVNQFCRE-UHFFFAOYSA-N

SMILES

C(S(CCN=C(NC#N)NC)=O)C1=C(C)N=CN1

Canonical SMILES

N#CNC(=NCCS(=O)CC=1NC=NC1C)NC

Other Names for this Substance

  • Guanidine, N-cyano-N′-methyl-N′′-[2-[[(4-methyl-1H-imidazol-5-yl)methyl]sulfinyl]ethyl]-
  • Guanidine, N-cyano-N′-methyl-N′′-[2-[[(5-methyl-1H-imidazol-4-yl)methyl]sulfinyl]ethyl]-
  • N-Cyano-N′-methyl-N′′-[2-[[(4-methyl-1H-imidazol-5-yl)methyl]sulfinyl]ethyl]guanidine
  • Cimetidine sulfoxide
  • (±)-Cimetidine S-oxide

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Deleted or Replaced CAS Registry Numbers

151378-35-7

CAS INSIGHTSTM
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