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Details

Stereochemistry ACHIRAL
Molecular Formula C18H20N4O4S
Molecular Weight 388.441
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2-((1-(BENZENESULFONYL)-2-METHYL-BENZIMIDAZOL-4-YL)AMINO)ETHYLAMINO)ACETIC ACID

SMILES

CC1=NC2=C(NCCNCC(O)=O)C=CC=C2N1S(=O)(=O)C3=CC=CC=C3

InChI

InChIKey=HEMUUZAZURLOSP-UHFFFAOYSA-N
InChI=1S/C18H20N4O4S/c1-13-21-18-15(20-11-10-19-12-17(23)24)8-5-9-16(18)22(13)27(25,26)14-6-3-2-4-7-14/h2-9,19-20H,10-12H2,1H3,(H,23,24)

HIDE SMILES / InChI

Molecular Formula C18H20N4O4S
Molecular Weight 388.441
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 15:34:02 GMT 2023
Edited
by admin
on Sat Dec 16 15:34:02 GMT 2023
Record UNII
KSH4SG1309
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(2-((1-(BENZENESULFONYL)-2-METHYL-BENZIMIDAZOL-4-YL)AMINO)ETHYLAMINO)ACETIC ACID
Systematic Name English
SAM-760 METABOLITE 7
Common Name English
Code System Code Type Description
FDA UNII
KSH4SG1309
Created by admin on Sat Dec 16 15:34:02 GMT 2023 , Edited by admin on Sat Dec 16 15:34:02 GMT 2023
PRIMARY
PUBCHEM
146019360
Created by admin on Sat Dec 16 15:34:02 GMT 2023 , Edited by admin on Sat Dec 16 15:34:02 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE