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Details

Stereochemistry ACHIRAL
Molecular Formula 2C24H26N4O3S.H2O4S
Molecular Weight 999.185
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MITAPIVAT SULFATE ANHYDROUS

SMILES

OS(O)(=O)=O.O=C(N1CCN(CC2CC2)CC1)C3=CC=C(NS(=O)(=O)C4=CC=CC5=C4N=CC=C5)C=C3.O=C(N6CCN(CC7CC7)CC6)C8=CC=C(NS(=O)(=O)C9=CC=CC%10=C9N=CC=C%10)C=C8

InChI

InChIKey=XNNUNDNGUZFBHS-UHFFFAOYSA-N
InChI=1S/2C24H26N4O3S.H2O4S/c2*29-24(28-15-13-27(14-16-28)17-18-6-7-18)20-8-10-21(11-9-20)26-32(30,31)22-5-1-3-19-4-2-12-25-23(19)22;1-5(2,3)4/h2*1-5,8-12,18,26H,6-7,13-17H2;(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula H2O4S
Molecular Weight 98.078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C24H26N4O3S
Molecular Weight 450.553
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 14:26:52 UTC 2023
Edited
by admin
on Sat Dec 16 14:26:52 UTC 2023
Record UNII
KM3KSE3QH9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MITAPIVAT SULFATE ANHYDROUS
USAN  
Common Name English
8-QUINOLINESULFONAMIDE, N-(4-((4-(CYCLOPROPYLMETHYL)-1-PIPERAZINYL)CARBONYL)PHENYL)-, SULFATE (2:1)
Systematic Name English
MITAPIVAT HEMISULFATE
Common Name English
Code System Code Type Description
FDA UNII
KM3KSE3QH9
Created by admin on Sat Dec 16 14:26:53 UTC 2023 , Edited by admin on Sat Dec 16 14:26:53 UTC 2023
PRIMARY
CAS
2329710-91-8
Created by admin on Sat Dec 16 14:26:53 UTC 2023 , Edited by admin on Sat Dec 16 14:26:53 UTC 2023
PRIMARY
PUBCHEM
139593419
Created by admin on Sat Dec 16 14:26:53 UTC 2023 , Edited by admin on Sat Dec 16 14:26:53 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
SOLVATE->ANHYDROUS
Related Record Type Details
ACTIVE MOIETY