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Details

Stereochemistry RACEMIC
Molecular Formula C21H22BrFN4O3S.CH4O3S
Molecular Weight 605.5
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MORPHOTHIADINE MESYLATE

SMILES

CCOC(=O)C1=C(CN2CCOCC2)NC(=NC1c3ccc(cc3Br)F)c4nccs4.CS(=O)(=O)O

InChI

InChIKey=FDMKMKYZDJHHFM-UHFFFAOYSA-N
InChI=1S/C21H22BrFN4O3S.CH4O3S/c1-2-30-21(28)17-16(12-27-6-8-29-9-7-27)25-19(20-24-5-10-31-20)26-18(17)14-4-3-13(23)11-15(14)22;1-5(2,3)4/h3-5,10-11,18H,2,6-9,12H2,1H3,(H,25,26);1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula C21H22BrFN4O3S
Molecular Weight 509.3932
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula CH4O3S
Molecular Weight 96.1068
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 Jun 26 13:41:57 UTC 2021
Edited
by admin
on Sat Jun 26 13:41:57 UTC 2021
Record UNII
AY5C7Q89Z2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MORPHOTHIADINE MESYLATE
Common Name English
MORPHOTHIADINE MESILATE
Common Name English
GLS-102
Common Name English
GLS-4 MESYLATE
Code English
GLS4 MESYLATE
Code English
5-PYRIMIDINECARBOXYLIC ACID, 4-(2-BROMO-4-FLUOROPHENYL)-1,4-DIHYDRO-6-(4-MORPHOLINYLMETHYL)-2-(2-THIAZOLYL)-, ETHYL ESTER, METHANESULFONATE (1:1)
Systematic Name English
Code System Code Type Description
CAS
1646361-04-7
Created by admin on Sat Jun 26 13:41:57 UTC 2021 , Edited by admin on Sat Jun 26 13:41:57 UTC 2021
PRIMARY
FDA UNII
AY5C7Q89Z2
Created by admin on Sat Jun 26 13:41:57 UTC 2021 , Edited by admin on Sat Jun 26 13:41:57 UTC 2021
PRIMARY
PUBCHEM
73437659
Created by admin on Sat Jun 26 13:41:57 UTC 2021 , Edited by admin on Sat Jun 26 13:41:57 UTC 2021
PRIMARY PUBCHEM
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PARENT -> SALT/SOLVATE
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ACTIVE MOIETY