U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C5H8N6O
Molecular Weight 168.1566
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of MTIC

SMILES

CN\N=N\C1=C(N=CN1)C(N)=O

InChI

InChIKey=MVBPAIHFZZKRGD-UHFFFAOYSA-N
InChI=1S/C5H8N6O/c1-7-11-10-5-3(4(6)12)8-2-9-5/h2H,1H3,(H2,6,12)(H,7,10)(H,8,9)

HIDE SMILES / InChI

Molecular Formula C5H8N6O
Molecular Weight 168.1566
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:20:31 GMT 2023
Edited
by admin
on Fri Dec 15 18:20:31 GMT 2023
Record UNII
PYY6H17XIV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MTIC
Common Name English
IMIDAZOLE-4-CARBOXAMIDE, 5-(3-METHYL-1-TRIAZENO)-
Systematic Name English
1H-IMIDAZOLE-4-CARBOXAMIDE, 5-(3-METHYL-1-TRIAZENYL)-
Systematic Name English
1H-Imidazole-4-carboxamide, 5-[(1E)-3-methyl-1-triazen-1-yl]
Systematic Name English
NSC-407347
Code English
5-(3-METHYLTRIAZ-1-EN-1-YL)-1H-IMIDAZOLE-4-CARBOXAMIDE
Systematic Name English
5-(3-METHYL-1-TRIAZENO)IMIDAZOLE-4-CARBOXAMIDE
Systematic Name English
5-[(1E)-3-Methyl-1-triazen-1-yl]-1H-imidazole-4-carboxamide
Systematic Name English
5-(3-METHYLTRIAZEN-1-YL)IMIDAZOLE-4-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
76953
Created by admin on Fri Dec 15 18:20:31 GMT 2023 , Edited by admin on Fri Dec 15 18:20:31 GMT 2023
PRIMARY
NSC
407347
Created by admin on Fri Dec 15 18:20:31 GMT 2023 , Edited by admin on Fri Dec 15 18:20:31 GMT 2023
PRIMARY
CAS
3413-72-7
Created by admin on Fri Dec 15 18:20:31 GMT 2023 , Edited by admin on Fri Dec 15 18:20:31 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
CHEBI
72568
Created by admin on Fri Dec 15 18:20:31 GMT 2023 , Edited by admin on Fri Dec 15 18:20:31 GMT 2023
PRIMARY
CAS
1232679-46-7
Created by admin on Fri Dec 15 18:20:31 GMT 2023 , Edited by admin on Fri Dec 15 18:20:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID40955666
Created by admin on Fri Dec 15 18:20:31 GMT 2023 , Edited by admin on Fri Dec 15 18:20:31 GMT 2023
PRIMARY
FDA UNII
PYY6H17XIV
Created by admin on Fri Dec 15 18:20:31 GMT 2023 , Edited by admin on Fri Dec 15 18:20:31 GMT 2023
PRIMARY
MESH
C010243
Created by admin on Fri Dec 15 18:20:31 GMT 2023 , Edited by admin on Fri Dec 15 18:20:31 GMT 2023
PRIMARY
Related Record Type Details
PRODRUG -> METABOLITE ACTIVE
PARENT -> METABOLITE
Related Record Type Details
ACTIVE MOIETY