U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C24H18N4S3
Molecular Weight 458.622
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-BIS(2-BENZOTHIAZOLYLMETHYL)-2-BENZOTHIAZOLEMETHANAMINE

SMILES

C(N(CC1=NC2=C(S1)C=CC=C2)CC3=NC4=C(S3)C=CC=C4)C5=NC6=C(S5)C=CC=C6

InChI

InChIKey=RYQOCRNXHKYKNY-UHFFFAOYSA-N
InChI=1S/C24H18N4S3/c1-4-10-19-16(7-1)25-22(29-19)13-28(14-23-26-17-8-2-5-11-20(17)30-23)15-24-27-18-9-3-6-12-21(18)31-24/h1-12H,13-15H2

HIDE SMILES / InChI

Molecular Formula C24H18N4S3
Molecular Weight 458.622
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 19:57:15 GMT 2025
Edited
by admin
on Tue Apr 01 19:57:15 GMT 2025
Record UNII
H5RGR21E67
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-349222
Preferred Name English
N,N-BIS(2-BENZOTHIAZOLYLMETHYL)-2-BENZOTHIAZOLEMETHANAMINE
Systematic Name English
1,3-BENZOTHIAZOL-2-YL-N,N-BIS(1,3-BENZOTHIAZOL-2-YLMETHYL)METHANAMINE
Systematic Name English
2-BENZOTHIAZOLEMETHANAMINE, N,N-BIS(2-BENZOTHIAZOLYLMETHYL)-
Systematic Name English
N,N',N''-TRIS(2-BENZOTHIAZOLYLMETHYL)AMINE
Systematic Name English
Code System Code Type Description
CAS
75472-28-5
Created by admin on Tue Apr 01 19:57:15 GMT 2025 , Edited by admin on Tue Apr 01 19:57:15 GMT 2025
PRIMARY
NSC
349222
Created by admin on Tue Apr 01 19:57:15 GMT 2025 , Edited by admin on Tue Apr 01 19:57:15 GMT 2025
PRIMARY
EPA CompTox
DTXSID80226408
Created by admin on Tue Apr 01 19:57:15 GMT 2025 , Edited by admin on Tue Apr 01 19:57:15 GMT 2025
PRIMARY
FDA UNII
H5RGR21E67
Created by admin on Tue Apr 01 19:57:15 GMT 2025 , Edited by admin on Tue Apr 01 19:57:15 GMT 2025
PRIMARY
PUBCHEM
336157
Created by admin on Tue Apr 01 19:57:15 GMT 2025 , Edited by admin on Tue Apr 01 19:57:15 GMT 2025
PRIMARY