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Chemistry

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Also known as: 32909-92-5, Sulfametrol, Sulfametrolum, 4-amino-n-(4-methoxy-1,2,5-thiadiazol-3-yl)benzenesulfonamide, F5ak41ipqg, N1-(4-methoxy-1,2,5-thiadiazol-3-yl)sulfanilamide
Molecular Formula
C9H10N4O3S2
Molecular Weight
286.3  g/mol
InChI Key
IZOYMGQQVNAMHS-UHFFFAOYSA-N
FDA UNII
F5AK41IPQG

Sulfametrole
Sulfametrole is a sulfonamide antibiotic used typically in combination with trimethoprim.
1 2D Structure

Sulfametrole

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-amino-N-(4-methoxy-1,2,5-thiadiazol-3-yl)benzenesulfonamide
2.1.2 InChI
InChI=1S/C9H10N4O3S2/c1-16-9-8(11-17-12-9)13-18(14,15)7-4-2-6(10)3-5-7/h2-5H,10H2,1H3,(H,11,13)
2.1.3 InChI Key
IZOYMGQQVNAMHS-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=NSN=C1NS(=O)(=O)C2=CC=C(C=C2)N
2.2 Other Identifiers
2.2.1 UNII
F5AK41IPQG
2.3 Synonyms
2.3.1 MeSH Synonyms

1. N-(4-methoxy-1,2,5-thiadiazol-3-yl)sulfanilamide

2. St 8005

3. Sulfametrol

2.3.2 Depositor-Supplied Synonyms

1. 32909-92-5

2. Sulfametrol

3. Sulfametrolum

4. 4-amino-n-(4-methoxy-1,2,5-thiadiazol-3-yl)benzenesulfonamide

5. F5ak41ipqg

6. N1-(4-methoxy-1,2,5-thiadiazol-3-yl)sulfanilamide

7. Sulfametrole (inn)

8. Sulfametrole [inn]

9. 4-amino-n-(4-methoxy-1,2,5-thiadiazol-3-yl)benzene-1-sulfonamide

10. Unii-f5ak41ipqg

11. Sulfametrole [inn:ban]

12. Sulfametrol [inn-spanish]

13. Sulfametrolum [inn-latin]

14. Lidaprim (tn)

15. Einecs 251-288-1

16. Sulfametrole [mi]

17. Sulfametrole [mart.]

18. Schembl148552

19. Sulfametrole [who-dd]

20. Chembl2105398

21. Chebi:88258

22. Gtpl12702

23. Dtxsid40865655

24. Izoymgqqvnamhs-uhfffaoysa-n

25. 4-amino-n-(5-methoxy-2,1,3-thiadiazol-4-yl)benzolsulfonamid

26. Hy-133937

27. Cs-0135813

28. Ft-0727929

29. Ns00004247

30. D08541

31. Q7636179

32. N1-(4-methoxy-1,2,5-thiadiazol-3-yl)-sulfanilamide

33. N(sup 1)-(4-methoxy-1,2,5-thiadiazol-3-yl)sulfanilamide

34. 3-methoxy-4-(4'-aminobenzene-sulfonamido)-1,2,5-thiadiazole

35. 3-methoxy-4-(4'-aminobenzenesulfonamido)-1,2,5-thiadiazole

36. Benzenesulfonamide, 4-amino-n-(4-methoxy-1,2,5-thiadiazol-3-yl)-; Sulfanilamide, N1-(4-methoxy-1,2,5-thiadiazol-3-yl)- (7ci,8ci); 1,2,5-thiadiazole, Benzenesulfonamide Deriv.; 4-amino-n-(4-methoxy-1,2,5-thiadiazol-3-yl)benzenesulfonamide; Sulfametrole

2.4 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 286.3 g/mol
Molecular Formula C9H10N4O3S2
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area144
Heavy Atom Count18
Formal Charge0
Complexity365
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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03-Sep-2021
18-May-2023
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