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Details

Stereochemistry ACHIRAL
Molecular Formula C13H21N5O4S
Molecular Weight 343.402
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-nitroso-ranitidine-1

SMILES

CN\C(=C/[N+]([O-])=O)N(CCSCC1=CC=C(CN(C)C)O1)N=O

InChI

InChIKey=CDVOJHFZFWUMSW-UKTHLTGXSA-N
InChI=1S/C13H21N5O4S/c1-14-13(9-18(20)21)17(15-19)6-7-23-10-12-5-4-11(22-12)8-16(2)3/h4-5,9,14H,6-8,10H2,1-3H3/b13-9+

HIDE SMILES / InChI

Molecular Formula C13H21N5O4S
Molecular Weight 343.402
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:27:22 GMT 2025
Edited
by admin
on Wed Apr 02 18:27:22 GMT 2025
Record UNII
QG9DUA3SZQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-nitroso-ranitidine-1
Preferred Name English
Code System Code Type Description
FDA UNII
QG9DUA3SZQ
Created by admin on Wed Apr 02 18:27:22 GMT 2025 , Edited by admin on Wed Apr 02 18:27:22 GMT 2025
PRIMARY
PUBCHEM
171390076
Created by admin on Wed Apr 02 18:27:22 GMT 2025 , Edited by admin on Wed Apr 02 18:27:22 GMT 2025
PRIMARY
Related Record Type Details
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