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Details

Stereochemistry ACHIRAL
Molecular Formula C4H6N4O2
Molecular Weight 142.116
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-METHYL-4-NITRO-1H-IMIDAZOL-5-AMINE

SMILES

CN1C=NC(=C1N)[N+]([O-])=O

InChI

InChIKey=GJVMTMXQJDQJSS-UHFFFAOYSA-N
InChI=1S/C4H6N4O2/c1-7-2-6-4(3(7)5)8(9)10/h2H,5H2,1H3

HIDE SMILES / InChI

Molecular Formula C4H6N4O2
Molecular Weight 142.116
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:49:33 GMT 2023
Edited
by admin
on Sat Dec 16 05:49:33 GMT 2023
Record UNII
55UIE6811G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-METHYL-4-NITRO-1H-IMIDAZOL-5-AMINE
Systematic Name English
NSC-400013
Code English
5-AMINO-1-METHYL-4-NITROIMIDAZOLE
Systematic Name English
AZATHIOPRINE IMPURITY A [EP IMPURITY]
Common Name English
IMIDAZOLE, 5-AMINO-1-METHYL-4-NITRO-
Systematic Name English
1H-IMIDAZOL-5-AMINE, 1-METHYL-4-NITRO-
Systematic Name English
AZATHIOPRINE RELATED COMPOUND A
USP-RS  
Common Name English
AZATHIOPRINE RELATED COMPOUND A [USP-RS]
Common Name English
Code System Code Type Description
FDA UNII
55UIE6811G
Created by admin on Sat Dec 16 05:49:33 GMT 2023 , Edited by admin on Sat Dec 16 05:49:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID70196469
Created by admin on Sat Dec 16 05:49:33 GMT 2023 , Edited by admin on Sat Dec 16 05:49:33 GMT 2023
PRIMARY
NSC
400013
Created by admin on Sat Dec 16 05:49:33 GMT 2023 , Edited by admin on Sat Dec 16 05:49:33 GMT 2023
PRIMARY
RS_ITEM_NUM
1045993
Created by admin on Sat Dec 16 05:49:33 GMT 2023 , Edited by admin on Sat Dec 16 05:49:33 GMT 2023
PRIMARY
CAS
4531-54-8
Created by admin on Sat Dec 16 05:49:33 GMT 2023 , Edited by admin on Sat Dec 16 05:49:33 GMT 2023
PRIMARY
PUBCHEM
20625
Created by admin on Sat Dec 16 05:49:33 GMT 2023 , Edited by admin on Sat Dec 16 05:49:33 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP