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Technical details about (4S)-1,1-dioxide-6-chloro-3,4-dihydro-2H-Thieno[3,2-e]-1,2-thiazin-4-ol, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 160982-16-1, (4s)-1,1-dioxide-6-chloro-3,4-dihydro-2h-thieno[3,2-e]-1,2-thiazin-4-ol, (4s)-6-chloro-1,1-dioxo-3,4-dihydro-2h-thieno[3,2-e]thiazin-4-ol, (s)-6-chloro-1,1-dioxo-1,2,3,4-tetrahydro-1lambda*6*-thieno[3,2-e][1,2]thiazin-4-ol, (s)-3,4-dihydro-6-chloro-4-hydroxy-2h-thieno[3,2-e]-1,2-thiazine-1,1-dioxide, Schembl3041948
Molecular Formula
C6H6ClNO3S2
Molecular Weight
239.7  g/mol
InChI Key
OFJGKGNJDCLNPM-SCSAIBSYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4S)-6-chloro-1,1-dioxo-3,4-dihydro-2H-thieno[3,2-e]thiazin-4-ol
2.1.2 InChI
InChI=1S/C6H6ClNO3S2/c7-5-1-3-4(9)2-8-13(10,11)6(3)12-5/h1,4,8-9H,2H2/t4-/m1/s1
2.1.3 InChI Key
OFJGKGNJDCLNPM-SCSAIBSYSA-N
2.1.4 Canonical SMILES
C1C(C2=C(SC(=C2)Cl)S(=O)(=O)N1)O
2.1.5 Isomeric SMILES
C1[C@H](C2=C(SC(=C2)Cl)S(=O)(=O)N1)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 160982-16-1

2. (4s)-1,1-dioxide-6-chloro-3,4-dihydro-2h-thieno[3,2-e]-1,2-thiazin-4-ol

3. (4s)-6-chloro-1,1-dioxo-3,4-dihydro-2h-thieno[3,2-e]thiazin-4-ol

4. (s)-6-chloro-1,1-dioxo-1,2,3,4-tetrahydro-1lambda*6*-thieno[3,2-e][1,2]thiazin-4-ol

5. (s)-3,4-dihydro-6-chloro-4-hydroxy-2h-thieno[3,2-e]-1,2-thiazine-1,1-dioxide

6. Schembl3041948

7. Dtxsid50471786

8. Mfcd09033311

9. Zinc22002671

10. Akos015897319

11. 2h-thieno[3,2-e]-1,2-thiazin-4-ol, 6-chloro-3,4-dihydro-, 1,1-dioxide, (4s)-

12. Ds-16381

13. Cs-0157325

14. A51043

15. 982c161

16. (s)-3,4-dihydro-6-chloro-4-hydroxy-2h-t

17. (4-s)-6-chloro-3,4-dihydro-2h-thieno[3,2-e][1,2]thiazin-4-ol 1,1-dioxide

18. (s)-6-chloro-1,1-dioxo-1,2,3,4-tetrahydro-1lambda6-thieno[3,2-e][1,2]thiazin-4-ol

19. (s)-6-chloro-3,4-dihydro-4-hydroxy-2h-thieno[3,2-e]-1,2-thiazine 1,1-dioxide

20. (s)-6-chloro-4-hydroxy-3,4-dihydro-2h-thieno-[3,2-e][1,2]thiazine 1,1-dioxide

21. (s)-6-chloro-4-hydroxy-3,4-dihydro-2h-thieno[3,2-e][1,2]thiazine1,1-dioxide

22. (4s)-6-chloro-4-hydroxy-3,4-dihydro-1lambda~6~-thieno[3,2-e][1,2]thiazine-1,1(2h)-dione

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 239.7 g/mol
Molecular Formula C6H6ClNO3S2
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass238.9477631 g/mol
Monoisotopic Mass238.9477631 g/mol
Topological Polar Surface Area103 Ų
Heavy Atom Count13
Formal Charge0
Complexity302
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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