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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H10N4S3
Molecular Weight 306.43
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-BENZYL-1H-IMIDAZO(4,5-D)PYRIDAZINE-2,4,7-TRITHIOL

SMILES

SC1=NN=C(S)C2=C1NC(=S)N2CC3=CC=CC=C3

InChI

InChIKey=ZEVCDJNCIXGPTA-UHFFFAOYSA-N
InChI=1S/C12H10N4S3/c17-10-8-9(11(18)15-14-10)16(12(19)13-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,13,19)(H,14,17)(H,15,18)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
NSC-66080
Preferred Name English
1-BENZYL-1H-IMIDAZO(4,5-D)PYRIDAZINE-2,4,7-TRITHIOL
Systematic Name English
1H-IMIDAZO(4,5-D)PYRIDAZINE-2,4,7(3H)-TRITHIONE, 5,6-DIHYDRO-1-(PHENYLMETHYL)-
Systematic Name English
Code System Code Type Description
NSC
66080
Created by admin on Tue Apr 01 20:03:11 GMT 2025 , Edited by admin on Tue Apr 01 20:03:11 GMT 2025
PRIMARY
FDA UNII
GX2Q10XX77
Created by admin on Tue Apr 01 20:03:11 GMT 2025 , Edited by admin on Tue Apr 01 20:03:11 GMT 2025
PRIMARY
CAS
3438-74-2
Created by admin on Tue Apr 01 20:03:11 GMT 2025 , Edited by admin on Tue Apr 01 20:03:11 GMT 2025
PRIMARY
PUBCHEM
3001003
Created by admin on Tue Apr 01 20:03:11 GMT 2025 , Edited by admin on Tue Apr 01 20:03:11 GMT 2025
PRIMARY
EPA CompTox
DTXSID70187953
Created by admin on Tue Apr 01 20:03:11 GMT 2025 , Edited by admin on Tue Apr 01 20:03:11 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966