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Details

Stereochemistry ACHIRAL
Molecular Formula C12H6Cl2N8S2
Molecular Weight 397.266
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,11-DICHLORO-3,9-DIMETHYL-6,12-DITHIA-1,2,3A,4,7,8,9A,10-OCTAAZA-DICYCLOPENTA(B,I)ANTHRACENE

SMILES

CC1=NN=C2SC3=C(Cl)C4=NN5C(C)=NN=C5SC4=C(Cl)C3=NN12

InChI

InChIKey=IPNGGVLIFDQZDO-UHFFFAOYSA-N
InChI=1S/C12H6Cl2N8S2/c1-3-15-17-11-21(3)19-7-5(13)10-8(6(14)9(7)23-11)20-22-4(2)16-18-12(22)24-10/h1-2H3

HIDE SMILES / InChI

Molecular Formula C12H6Cl2N8S2
Molecular Weight 397.266
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 12:56:40 GMT 2023
Edited
by admin
on Sat Dec 16 12:56:40 GMT 2023
Record UNII
7XPP3587EJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,11-DICHLORO-3,9-DIMETHYL-6,12-DITHIA-1,2,3A,4,7,8,9A,10-OCTAAZA-DICYCLOPENTA(B,I)ANTHRACENE
Systematic Name English
6,13-DICHLORO-3,10-DIMETHYL-1,2,4-TRIAZOLO(3,4-B)(1,2,4)TRIAZOLO(3',4':2,3)(1,3,4)THIADIAZINO(6,5-G)(1,3,4)BENZOTHIADIAZINE
Systematic Name English
NSC-320037
Code English
1,2,4-TRIAZOLO(3,4-B)(1,2,4)TRIAZOLO(3',4':2,3)(1,3,4)THIADIAZINO(6,5-G)(1,3,4)BENZOTHIADIAZINE, 6,13-DICHLORO-3,10-DIMETHYL-
Systematic Name English
Code System Code Type Description
CAS
69560-87-8
Created by admin on Sat Dec 16 12:56:40 GMT 2023 , Edited by admin on Sat Dec 16 12:56:40 GMT 2023
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FDA UNII
7XPP3587EJ
Created by admin on Sat Dec 16 12:56:40 GMT 2023 , Edited by admin on Sat Dec 16 12:56:40 GMT 2023
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EPA CompTox
DTXSID30219820
Created by admin on Sat Dec 16 12:56:40 GMT 2023 , Edited by admin on Sat Dec 16 12:56:40 GMT 2023
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PUBCHEM
330762
Created by admin on Sat Dec 16 12:56:40 GMT 2023 , Edited by admin on Sat Dec 16 12:56:40 GMT 2023
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NSC
320037
Created by admin on Sat Dec 16 12:56:40 GMT 2023 , Edited by admin on Sat Dec 16 12:56:40 GMT 2023
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