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Details

Stereochemistry ACHIRAL
Molecular Formula C9H8N2S
Molecular Weight 176.238
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(METHYLTHIO)CINNOLINE

SMILES

CSC1=C2C=CC=CC2=NN=C1

InChI

InChIKey=ZZCPXQKWVPJNSJ-UHFFFAOYSA-N
InChI=1S/C9H8N2S/c1-12-9-6-10-11-8-5-3-2-4-7(8)9/h2-6H,1H3

HIDE SMILES / InChI

Molecular Formula C9H8N2S
Molecular Weight 176.238
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 Tue Apr 01 19:49:50 GMT 2025
Edited
by admin
on Tue Apr 01 19:49:50 GMT 2025
Record UNII
XFQ5CU9RQ3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(METHYLTHIO)CINNOLINE
Systematic Name English
NSC-39362
Preferred Name English
CINNOLINE, 4-(METHYLTHIO)-
Systematic Name English
Code System Code Type Description
FDA UNII
XFQ5CU9RQ3
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID10169354
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY
CAS
1726-85-8
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY
NSC
39362
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY
PUBCHEM
236663
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY