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Details

Stereochemistry ACHIRAL
Molecular Formula C31H36ClN3O5S.2C2H6O3S
Molecular Weight 818.417
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METOFENAZATE DIESYLATE

SMILES

CCS(O)(=O)=O.CCS(O)(=O)=O.COC1=CC(=CC(OC)=C1OC)C(=O)OCCN2CCN(CCCN3C4=C(SC5=C3C=C(Cl)C=C5)C=CC=C4)CC2

InChI

InChIKey=YUUZEPKGGQPQLT-UHFFFAOYSA-N
InChI=1S/C31H36ClN3O5S.2C2H6O3S/c1-37-26-19-22(20-27(38-2)30(26)39-3)31(36)40-18-17-34-15-13-33(14-16-34)11-6-12-35-24-7-4-5-8-28(24)41-29-10-9-23(32)21-25(29)35;2*1-2-6(3,4)5/h4-5,7-10,19-21H,6,11-18H2,1-3H3;2*2H2,1H3,(H,3,4,5)

HIDE SMILES / InChI

Molecular Formula C2H6O3S
Molecular Weight 110.132
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C31H36ClN3O5S
Molecular Weight 598.153
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 Mon Mar 31 21:24:47 GMT 2025
Edited
by admin
on Mon Mar 31 21:24:47 GMT 2025
Record UNII
YM9W99502E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOIC ACID, 3,4,5-TRIMETHOXY-, 2-(4-(3-(2-CHLORO-10H-PHENOTHIAZIN-10-YL)PROPYL)-1-PIPERAZINYL)ETHYL ESTER, ETHANESULFONATE (1:2)
Preferred Name English
METOFENAZATE DIESYLATE
Common Name English
BENZOIC ACID, 3,4,5-TRIMETHOXY-, 2-(4-(3-(2-CHLOROPHENOTHIAZIN-10-YL)PROPYL)-1-PIPERAZINYL)ETHYL ESTER, DIETHANESULFONATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID30168283
Created by admin on Mon Mar 31 21:24:47 GMT 2025 , Edited by admin on Mon Mar 31 21:24:47 GMT 2025
PRIMARY
PUBCHEM
15482
Created by admin on Mon Mar 31 21:24:47 GMT 2025 , Edited by admin on Mon Mar 31 21:24:47 GMT 2025
PRIMARY
CAS
1674-48-2
Created by admin on Mon Mar 31 21:24:47 GMT 2025 , Edited by admin on Mon Mar 31 21:24:47 GMT 2025
PRIMARY
FDA UNII
YM9W99502E
Created by admin on Mon Mar 31 21:24:47 GMT 2025 , Edited by admin on Mon Mar 31 21:24:47 GMT 2025
PRIMARY