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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H14N2O4S3
Molecular Weight 346.446
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N2-((4-METHYLPHENYL)METHYL)THIOPHENE-2,5-DISULFONAMIDE

SMILES

CC1=CC=C(CNS(=O)(=O)C2=CC=C(S2)S(N)(=O)=O)C=C1

InChI

InChIKey=GUNRMHMEAWSZQE-UHFFFAOYSA-N
InChI=1S/C12H14N2O4S3/c1-9-2-4-10(5-3-9)8-14-21(17,18)12-7-6-11(19-12)20(13,15)16/h2-7,14H,8H2,1H3,(H2,13,15,16)

HIDE SMILES / InChI

Molecular Formula C12H14N2O4S3
Molecular Weight 346.446
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 16:32:58 GMT 2023
Edited
by admin
on Sat Dec 16 16:32:58 GMT 2023
Record UNII
409XZT1EFW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N2-((4-METHYLPHENYL)METHYL)THIOPHENE-2,5-DISULFONAMIDE
Systematic Name English
AL-5917
Code English
2,5-THIOPHENEDISULFONAMIDE, N2-((4-METHYLPHENYL)METHYL)-
Systematic Name English
THIOPHENE-2,5-DISULFONIC ACID 2-AMIDE-5-(4-METHYL-BENZYLAMIDE)
Systematic Name English
AL5917
Code English
Code System Code Type Description
CAS
220402-80-2
Created by admin on Sat Dec 16 16:32:58 GMT 2023 , Edited by admin on Sat Dec 16 16:32:58 GMT 2023
PRIMARY
FDA UNII
409XZT1EFW
Created by admin on Sat Dec 16 16:32:58 GMT 2023 , Edited by admin on Sat Dec 16 16:32:58 GMT 2023
PRIMARY
PUBCHEM
444607
Created by admin on Sat Dec 16 16:32:58 GMT 2023 , Edited by admin on Sat Dec 16 16:32:58 GMT 2023
PRIMARY