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Details

Stereochemistry ACHIRAL
Molecular Formula C19H21N5O2
Molecular Weight 351.4023
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 2-[[[4-(aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazole-5-carboxylate

SMILES

CCOC(=O)C1=CC=C2N(C)C(CNC3=CC=C(C=C3)C(N)=N)=NC2=C1

InChI

InChIKey=PPAZZPSWYIRKMT-UHFFFAOYSA-N
InChI=1S/C19H21N5O2/c1-3-26-19(25)13-6-9-16-15(10-13)23-17(24(16)2)11-22-14-7-4-12(5-8-14)18(20)21/h4-10,22H,3,11H2,1-2H3,(H3,20,21)

HIDE SMILES / InChI

Molecular Formula C19H21N5O2
Molecular Weight 351.4023
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 19:22:29 GMT 2023
Edited
by admin
on Sat Dec 16 19:22:29 GMT 2023
Record UNII
RQ6ZP7QW26
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl 2-[[[4-(aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazole-5-carboxylate
Systematic Name English
1H-Benzimidazole-5-carboxylic acid, 2-[[[4-(aminoiminomethyl)phenyl]amino]methyl]-1-methyl-, ethyl ester
Systematic Name English
Code System Code Type Description
CAS
1408238-41-4
Created by admin on Sat Dec 16 19:22:29 GMT 2023 , Edited by admin on Sat Dec 16 19:22:29 GMT 2023
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EPA CompTox
DTXSID301111035
Created by admin on Sat Dec 16 19:22:29 GMT 2023 , Edited by admin on Sat Dec 16 19:22:29 GMT 2023
PRIMARY
FDA UNII
RQ6ZP7QW26
Created by admin on Sat Dec 16 19:22:29 GMT 2023 , Edited by admin on Sat Dec 16 19:22:29 GMT 2023
PRIMARY
PUBCHEM
71607574
Created by admin on Sat Dec 16 19:22:29 GMT 2023 , Edited by admin on Sat Dec 16 19:22:29 GMT 2023
PRIMARY