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Details

Stereochemistry ACHIRAL
Molecular Formula C24H38N2.CH4O3S
Molecular Weight 450.678
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MILATEGRAST MESYLATE

SMILES

CS(O)(=O)=O.CC1(C)CC(CC(C)(C)C1)C2=CC=CC=C2N3CCN(CC4CC4)CC3

InChI

InChIKey=AEHZBEGUMKAEQG-UHFFFAOYSA-N
InChI=1S/C24H38N2.CH4O3S/c1-23(2)15-20(16-24(3,4)18-23)21-7-5-6-8-22(21)26-13-11-25(12-14-26)17-19-9-10-19;1-5(2,3)4/h5-8,19-20H,9-18H2,1-4H3;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 C24H38N2
Molecular Weight 354.5719
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 11:03:28 UTC 2023
Edited
by admin
on Sat Dec 16 11:03:28 UTC 2023
Record UNII
8W7OKS3WDN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MILATEGRAST MESYLATE
Common Name English
Code System Code Type Description
CAS
894776-23-9
Created by admin on Sat Dec 16 11:03:28 UTC 2023 , Edited by admin on Sat Dec 16 11:03:28 UTC 2023
PRIMARY
PUBCHEM
11633798
Created by admin on Sat Dec 16 11:03:28 UTC 2023 , Edited by admin on Sat Dec 16 11:03:28 UTC 2023
PRIMARY
FDA UNII
8W7OKS3WDN
Created by admin on Sat Dec 16 11:03:28 UTC 2023 , Edited by admin on Sat Dec 16 11:03:28 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY