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Details

Stereochemistry ACHIRAL
Molecular Formula C11H7Cl5S
Molecular Weight 348.503
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BENZYLPENTACHLOROBUTA-1,3-DIENYL SULFIDE

SMILES

ClC(Cl)=C(Cl)C(Cl)=C(Cl)SCC1=CC=CC=C1

InChI

InChIKey=OCXCOAHYQNOLST-LUAWRHEFSA-N
InChI=1S/C11H7Cl5S/c12-8(10(14)15)9(13)11(16)17-6-7-4-2-1-3-5-7/h1-5H,6H2/b11-9-

HIDE SMILES / InChI

Molecular Formula C11H7Cl5S
Molecular Weight 348.503
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:35:05 GMT 2023
Edited
by admin
on Sat Dec 16 08:35:05 GMT 2023
Record UNII
722E5933MV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZYLPENTACHLOROBUTA-1,3-DIENYL SULFIDE
Systematic Name English
BENZENE, (((1,2,3,4,4-PENTACHLORO-1,3-BUTADIEN-1-YL)THIO)METHYL)-
Systematic Name English
BENZYL 1,2,3,4,4-PENTACHLOROBUTADIENYL SULFIDE
Systematic Name English
(((1,2,3,4,4-PENTACHLORO-1,3-BUTADIEN-1-YL)THIO)METHYL)BENZENE
Systematic Name English
Code System Code Type Description
CAS
111959-96-7
Created by admin on Sat Dec 16 08:35:05 GMT 2023 , Edited by admin on Sat Dec 16 08:35:05 GMT 2023
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FDA UNII
722E5933MV
Created by admin on Sat Dec 16 08:35:05 GMT 2023 , Edited by admin on Sat Dec 16 08:35:05 GMT 2023
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EPA CompTox
DTXSID101030839
Created by admin on Sat Dec 16 08:35:05 GMT 2023 , Edited by admin on Sat Dec 16 08:35:05 GMT 2023
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PUBCHEM
159474
Created by admin on Sat Dec 16 08:35:05 GMT 2023 , Edited by admin on Sat Dec 16 08:35:05 GMT 2023
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