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Details

Stereochemistry ACHIRAL
Molecular Formula C8H11NO2S
Molecular Weight 185.243
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYLSULFONYLBENZYLAMINE

SMILES

CS(=O)(=O)C1=CC=C(CN)C=C1

InChI

InChIKey=VMNXLLDFGVEBLE-UHFFFAOYSA-N
InChI=1S/C8H11NO2S/c1-12(10,11)8-4-2-7(6-9)3-5-8/h2-5H,6,9H2,1H3

HIDE SMILES / InChI

Molecular Formula C8H11NO2S
Molecular Weight 185.243
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:28:27 GMT 2025
Edited
by admin
on Mon Mar 31 21:28:27 GMT 2025
Record UNII
61O466WZW2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-METHYLSULFONYLBENZYLAMINE
Systematic Name English
4-METYLSULFONYLBENSYLAMIN
Preferred Name English
BENZENEMETHANAMINE, 4-(METHYLSULFONYL)-
Systematic Name English
4-(METHYLSULFONYL)BENZYLAMINE
Systematic Name English
4-(METHANESULFONYL)BENZYLAMINE
Systematic Name English
(4-(METHYLSULFONYL)PHENYL)METHANAMINE
Systematic Name English
P-(METHYLSULFONYL)BENZYLAMINE )-
Systematic Name English
BENZENEMETHANAMINE, 4-(BENZYLAMINE, P-(METHYLSULFONYL)-
Systematic Name English
(4-(METHYLSULFONYL)PHENYL)METHANEAMINE
Systematic Name English
4-(METHYLSULFONYL)BENZENEMETHANAMINE
Systematic Name English
Code System Code Type Description
CAS
4393-16-2
Created by admin on Mon Mar 31 21:28:27 GMT 2025 , Edited by admin on Mon Mar 31 21:28:27 GMT 2025
PRIMARY
FDA UNII
61O466WZW2
Created by admin on Mon Mar 31 21:28:27 GMT 2025 , Edited by admin on Mon Mar 31 21:28:27 GMT 2025
PRIMARY
EPA CompTox
DTXSID20963148
Created by admin on Mon Mar 31 21:28:27 GMT 2025 , Edited by admin on Mon Mar 31 21:28:27 GMT 2025
PRIMARY
CAS
1513716-78-3
Created by admin on Mon Mar 31 21:28:27 GMT 2025 , Edited by admin on Mon Mar 31 21:28:27 GMT 2025
SUPERSEDED
PUBCHEM
57421
Created by admin on Mon Mar 31 21:28:27 GMT 2025 , Edited by admin on Mon Mar 31 21:28:27 GMT 2025
PRIMARY
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ACTIVE MOIETY