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Details

Stereochemistry ACHIRAL
Molecular Formula C13H12ClN3O.ClH
Molecular Weight 298.168
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CI-953

SMILES

Cl.CC1=C(NC(=O)NC2=CC=NC=C2)C(Cl)=CC=C1

InChI

InChIKey=AQIVEWAADQUAHH-UHFFFAOYSA-N
InChI=1S/C13H12ClN3O.ClH/c1-9-3-2-4-11(14)12(9)17-13(18)16-10-5-7-15-8-6-10;/h2-8H,1H3,(H2,15,16,17,18);1H

HIDE SMILES / InChI

Molecular Formula C13H12ClN3O
Molecular Weight 261.707
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Oct 22 12:35:30 UTC 2019
Edited
by admin
on Tue Oct 22 12:35:30 UTC 2019
Record UNII
4DX3VNX2XV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CI-953
Code English
UREA, N-(2-CHLORO-6-METHYLPHENYL)-N'-4-PYRIDINYL-, HYDROCHLORIDE (1:1)
Systematic Name English
N-(2-CHLORO-6-METHYLPHENYL)-N'-4-PYRIDINYLUREA HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
CAS
124421-10-9
Created by admin on Tue Oct 22 12:35:30 UTC 2019 , Edited by admin on Tue Oct 22 12:35:30 UTC 2019
PRIMARY
Related Record Type Details
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