Details
Stereochemistry | ACHIRAL |
Molecular Formula | C19H20Br2N6O4S |
Molecular Weight | 588.273 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCNS(=O)(=O)NC1=NC=NC(OCCOC2=NC=C(Br)C=N2)=C1C3=CC=C(Br)C=C3
InChI
InChIKey=JGCMEBMXRHSZKX-UHFFFAOYSA-N
InChI=1S/C19H20Br2N6O4S/c1-2-7-26-32(28,29)27-17-16(13-3-5-14(20)6-4-13)18(25-12-24-17)30-8-9-31-19-22-10-15(21)11-23-19/h3-6,10-12,26H,2,7-9H2,1H3,(H,24,25,27)
Molecular Formula | C19H20Br2N6O4S |
Molecular Weight | 588.273 |
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
Edited
Sat Dec 16 17:43:58 UTC 2023
by
admin
on
Sat Dec 16 17:43:58 UTC 2023
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Record UNII |
Z9K9Y9WMVL
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Record Status |
Validated (UNII)
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Record Version |
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-
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Official Name | English | ||
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Brand Name | English | ||
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Code | English | ||
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Systematic Name | English | ||
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Code | English | ||
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Classification Tree | Code System | Code | ||
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WHO-ATC |
C02KX04
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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FDA ORPHAN DRUG |
580117
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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EMA ASSESSMENT REPORTS |
OPSUMIT (AUTHORIZED: HYPERTENSION, PULMONARY)
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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FDA ORPHAN DRUG |
282209
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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WHO-VATC |
QC02KX04
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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FDA ORPHAN DRUG |
509615
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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FDA ORPHAN DRUG |
574917
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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NDF-RT |
N0000175581
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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FDA ORPHAN DRUG |
279309
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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EU-Orphan Drug |
EU/3/11/909
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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Code System | Code | Type | Description | ||
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9018
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PRIMARY | |||
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m6975
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admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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PRIMARY | Merck Index | ||
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16004692
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SUB89247
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441798-33-0
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76607
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1442132
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PRIMARY | RxNorm | ||
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DB08932
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4809
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7352
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Z9K9Y9WMVL
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DTXSID50196063
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100000140050
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CHEMBL2103873
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Macitentan
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PRIMARY | |||
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YY-66
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Z9K9Y9WMVL
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PRIMARY | |||
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C87728
Created by
admin on Sat Dec 16 17:43:59 UTC 2023 , Edited by admin on Sat Dec 16 17:43:59 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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METABOLIC ENZYME -> SUBSTRATE |
MAJOR
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TARGET -> INHIBITOR |
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METABOLIC ENZYME -> SUBSTRATE |
MINOR
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BINDER->LIGAND |
BINDING
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METABOLITE ACTIVE -> PARENT | |||
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METABOLITE -> PARENT |
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ACTIVE MOIETY |
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Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Volume of Distribution | PHARMACOKINETIC |
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Tmax | PHARMACOKINETIC |
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ORAL ADMINISTRATION |
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Biological Half-life | PHARMACOKINETIC |
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