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

Details

Stereochemistry ACHIRAL
Molecular Formula C4H7NO2S2
Molecular Weight 165.234
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-NITRO-2,2-BIS(METHYLTHIO)ETHYLENE

SMILES

CSC(SC)=C[N+]([O-])=O

InChI

InChIKey=NXGHEDHQXXXTTP-UHFFFAOYSA-N
InChI=1S/C4H7NO2S2/c1-8-4(9-2)3-5(6)7/h3H,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-241513
Preferred Name English
1-NITRO-2,2-BIS(METHYLTHIO)ETHYLENE
Systematic Name English
ETHENE, 1,1-BIS(METHYLTHIO)-2-NITRO-
Systematic Name English
1,1-BIS(METHYLTHIO)-2-NITROETHENE
Systematic Name English
1,1-BIS(METHYLSULFANYL)-2-NITROETHENE
Systematic Name English
Code System Code Type Description
NSC
241513
Created by admin on Wed Apr 02 01:38:53 GMT 2025 , Edited by admin on Wed Apr 02 01:38:53 GMT 2025
PRIMARY
EPA CompTox
DTXSID90159738
Created by admin on Wed Apr 02 01:38:53 GMT 2025 , Edited by admin on Wed Apr 02 01:38:53 GMT 2025
PRIMARY
PUBCHEM
83623
Created by admin on Wed Apr 02 01:38:53 GMT 2025 , Edited by admin on Wed Apr 02 01:38:53 GMT 2025
PRIMARY
CAS
13623-94-4
Created by admin on Wed Apr 02 01:38:53 GMT 2025 , Edited by admin on Wed Apr 02 01:38:53 GMT 2025
PRIMARY
ECHA (EC/EINECS)
237-108-4
Created by admin on Wed Apr 02 01:38:53 GMT 2025 , Edited by admin on Wed Apr 02 01:38:53 GMT 2025
PRIMARY
FDA UNII
38A002C515
Created by admin on Wed Apr 02 01:38:53 GMT 2025 , Edited by admin on Wed Apr 02 01:38:53 GMT 2025
PRIMARY