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Details

Stereochemistry RACEMIC
Molecular Formula C10H16N6OS
Molecular Weight 268.3401
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CIMETIDINE SULFOXIDE

SMILES

Cc1c(CS(=O)CCNC(=NC)NC#N)[nH]cn1

InChI

InChIKey=HOJLJLYVNQFCRE-UHFFFAOYSA-N
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)

HIDE SMILES / InChI

Molecular Formula C10H16N6OS
Molecular Weight 268.3401
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 11:45:53 UTC 2021
Edited
by admin
on Sat Jun 26 11:45:53 UTC 2021
Record UNII
H6V3T9UG74
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CIMETIDINE SULFOXIDE
Common Name English
(+/-)-CIMETIDINE S-OXIDE
Common Name English
SKF-92452
Code English
CIMETIDINE SULFOXIDE, (+/-)-
Common Name English
GUANIDINE, N-CYANO-N'-METHYL-N''-(2-(((4-METHYL-1H-IMIDAZOL-5-YL)METHYL)SULFINYL)ETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
H6V3T9UG74
Created by admin on Sat Jun 26 11:45:53 UTC 2021 , Edited by admin on Sat Jun 26 11:45:53 UTC 2021
PRIMARY
PUBCHEM
62949
Created by admin on Sat Jun 26 11:45:53 UTC 2021 , Edited by admin on Sat Jun 26 11:45:53 UTC 2021
PRIMARY
CAS
54237-72-8
Created by admin on Sat Jun 26 11:45:53 UTC 2021 , Edited by admin on Sat Jun 26 11:45:53 UTC 2021
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE
Related Record Type Details
PARENT -> METABOLITE