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Details

Stereochemistry ACHIRAL
Molecular Formula C22H14Cl4N2S2
Molecular Weight 512.302
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,6-Bis((3,4-dichlorobenzyl)thio)cinnoline

SMILES

ClC1=CC=C(CSC2=CN=NC3=CC=C(SCC4=CC(Cl)=C(Cl)C=C4)C=C23)C=C1Cl

InChI

InChIKey=OVBOZUJIYJCQCG-UHFFFAOYSA-N
InChI=1S/C22H14Cl4N2S2/c23-17-4-1-13(7-19(17)25)11-29-15-3-6-21-16(9-15)22(10-27-28-21)30-12-14-2-5-18(24)20(26)8-14/h1-10H,11-12H2

HIDE SMILES / InChI

Molecular Formula C22H14Cl4N2S2
Molecular Weight 512.302
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 12:43:53 GMT 2023
Edited
by admin
on Sat Dec 16 12:43:53 GMT 2023
Record UNII
4Q9XA8VC3S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4,6-Bis((3,4-dichlorobenzyl)thio)cinnoline
Systematic Name English
Cinnoline, 4,6-bis[[(3,4-dichlorophenyl)methyl]thio]-
Systematic Name English
4,6-Bis[[(3,4-dichlorophenyl)methyl]thio]cinnoline
Systematic Name English
Cinnoline, 4,6-bis[(3,4-dichlorobenzyl)thio]-
Systematic Name English
NSC-66128
Code English
Code System Code Type Description
PUBCHEM
248725
Created by admin on Sat Dec 16 12:43:53 GMT 2023 , Edited by admin on Sat Dec 16 12:43:53 GMT 2023
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NSC
66128
Created by admin on Sat Dec 16 12:43:53 GMT 2023 , Edited by admin on Sat Dec 16 12:43:53 GMT 2023
PRIMARY
FDA UNII
4Q9XA8VC3S
Created by admin on Sat Dec 16 12:43:53 GMT 2023 , Edited by admin on Sat Dec 16 12:43:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID70219829
Created by admin on Sat Dec 16 12:43:53 GMT 2023 , Edited by admin on Sat Dec 16 12:43:53 GMT 2023
PRIMARY
CAS
6957-44-4
Created by admin on Sat Dec 16 12:43:53 GMT 2023 , Edited by admin on Sat Dec 16 12:43:53 GMT 2023
PRIMARY