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Details

Stereochemistry ACHIRAL
Molecular Formula C21H19N5O2.2CH4O3S
Molecular Weight 565.619
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SEPIMOSTAT MESYLATE

SMILES

CS(O)(=O)=O.CS(O)(=O)=O.NC(=N)C1=CC2=C(C=C1)C=C(OC(=O)C3=CC=C(NC4=NCCN4)C=C3)C=C2

InChI

InChIKey=ICYICMXERRTCPY-UHFFFAOYSA-N
InChI=1S/C21H19N5O2.2CH4O3S/c22-19(23)16-2-1-15-12-18(8-5-14(15)11-16)28-20(27)13-3-6-17(7-4-13)26-21-24-9-10-25-21;2*1-5(2,3)4/h1-8,11-12H,9-10H2,(H3,22,23)(H2,24,25,26);2*1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula CH4O3S
Molecular Weight 96.106
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C21H19N5O2
Molecular Weight 373.4079
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 Fri Dec 15 18:07:34 UTC 2023
Edited
by admin
on Fri Dec 15 18:07:34 UTC 2023
Record UNII
8MW790BPKQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SEPIMOSTAT MESYLATE
Common Name English
BENZOIC ACID, 4-((4,5-DIHYDRO-1H-IMIDAZOL-2-YL)AMINO)-, 6-(AMINOIMINOMETHYL)-2-NAPHTHALENYL ESTER, METHANESULFONATE (1:2)
Systematic Name English
SEPIMOSTAT METHANESULFONATE [MI]
Common Name English
RENOFUTHAN
Brand Name English
SEPIMOSTAT MESILATE [JAN]
Common Name English
SEPIMOSTAT MESILATE
Common Name English
SEPIMOSTATE MESILATE
Common Name English
FUT-187
Code English
TO-187
Code English
SEPIMOSTAT METHANESULFONATE
MI  
Common Name English
Code System Code Type Description
PUBCHEM
6918061
Created by admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
PRIMARY
CAS
103926-82-5
Created by admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
PRIMARY
MESH
C058875
Created by admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
PRIMARY
FDA UNII
8MW790BPKQ
Created by admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
PRIMARY
MERCK INDEX
m925
Created by admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
PRIMARY Merck Index
EPA CompTox
DTXSID50908668
Created by admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE