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Details

Stereochemistry ACHIRAL
Molecular Formula C18H20N4O5S2
Molecular Weight 436.505
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(1-(BENZENESULFONYL)-2-METHYL-BENZIMIDAZOL-4-YL)PIPERAZINE-1-SULFONIC ACID

SMILES

CC1=NC2=C(C=CC=C2N1S(=O)(=O)C3=CC=CC=C3)N4CCN(CC4)S(O)(=O)=O

InChI

InChIKey=NHZOTXHFXMIFFI-UHFFFAOYSA-N
InChI=1S/C18H20N4O5S2/c1-14-19-18-16(20-10-12-21(13-11-20)29(25,26)27)8-5-9-17(18)22(14)28(23,24)15-6-3-2-4-7-15/h2-9H,10-13H2,1H3,(H,25,26,27)

HIDE SMILES / InChI

Molecular Formula C18H20N4O5S2
Molecular Weight 436.505
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 15:16:45 GMT 2023
Edited
by admin
on Sat Dec 16 15:16:45 GMT 2023
Record UNII
W6L9B33Q36
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(1-(BENZENESULFONYL)-2-METHYL-BENZIMIDAZOL-4-YL)PIPERAZINE-1-SULFONIC ACID
Systematic Name English
SAM-760 METABOLITE 12
Common Name English
Code System Code Type Description
FDA UNII
W6L9B33Q36
Created by admin on Sat Dec 16 15:16:45 GMT 2023 , Edited by admin on Sat Dec 16 15:16:45 GMT 2023
PRIMARY
PUBCHEM
156596637
Created by admin on Sat Dec 16 15:16:45 GMT 2023 , Edited by admin on Sat Dec 16 15:16:45 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE