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Details

Stereochemistry ACHIRAL
Molecular Formula C28H20N4S2
Molecular Weight 476.615
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2,2'-(Azodi-p-phenylene)bis(6-methylbenzothiazole)

SMILES

CC1=CC=C2N=C(SC2=C1)C3=CC=C(C=C3)\N=N\C4=CC=C(C=C4)C5=NC6=CC=C(C)C=C6S5

InChI

InChIKey=OIWUWXCWLGMXKH-QNEJGDQOSA-N
InChI=1S/C28H20N4S2/c1-17-3-13-23-25(15-17)33-27(29-23)19-5-9-21(10-6-19)31-32-22-11-7-20(8-12-22)28-30-24-14-4-18(2)16-26(24)34-28/h3-16H,1-2H3/b32-31+

HIDE SMILES / InChI

Molecular Formula C28H20N4S2
Molecular Weight 476.615
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 12:28:08 GMT 2023
Edited
by admin
on Sat Dec 16 12:28:08 GMT 2023
Record UNII
Q46N4M2FE8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2'-(Azodi-p-phenylene)bis(6-methylbenzothiazole)
Systematic Name English
2,2′-(1,2-Diazenediyldi-4,1-phenylene)bis[6-methylbenzothiazole]
Systematic Name English
Benzothiazole, 2,2′-(azodi-4,1-phenylene)bis[6-methyl-
Systematic Name English
Benzothiazole, 2,2′-(1,2-diazenediyldi-4,1-phenylene)bis[6-methyl-
Systematic Name English
Code System Code Type Description
FDA UNII
Q46N4M2FE8
Created by admin on Sat Dec 16 12:28:08 GMT 2023 , Edited by admin on Sat Dec 16 12:28:08 GMT 2023
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PUBCHEM
87000
Created by admin on Sat Dec 16 12:28:08 GMT 2023 , Edited by admin on Sat Dec 16 12:28:08 GMT 2023
PRIMARY
CAS
17205-68-4
Created by admin on Sat Dec 16 12:28:08 GMT 2023 , Edited by admin on Sat Dec 16 12:28:08 GMT 2023
PRIMARY
ECHA (EC/EINECS)
241-248-1
Created by admin on Sat Dec 16 12:28:08 GMT 2023 , Edited by admin on Sat Dec 16 12:28:08 GMT 2023
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EPA CompTox
DTXSID9066176
Created by admin on Sat Dec 16 12:28:08 GMT 2023 , Edited by admin on Sat Dec 16 12:28:08 GMT 2023
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