Details
Stereochemistry | ACHIRAL |
Molecular Formula | C8H9BrN2.C7H8O3S |
Molecular Weight | 385.276 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.NC(=N)CC2=CC=C(Br)C=C2
InChI
InChIKey=KVBHJSYQSARJOY-UHFFFAOYSA-N
InChI=1S/C8H9BrN2.C7H8O3S/c9-7-3-1-6(2-4-7)5-8(10)11;1-6-2-4-7(5-3-6)11(8,9)10/h1-4H,5H2,(H3,10,11);2-5H,1H3,(H,8,9,10)
Molecular Formula | C8H9BrN2 |
Molecular Weight | 213.074 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C7H8O3S |
Molecular Weight | 172.202 |
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
Fri Dec 15 14:58:20 GMT 2023
by
admin
on
Fri Dec 15 14:58:20 GMT 2023
|
Record UNII |
SO7S8405GC
|
Record Status |
Validated (UNII)
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Record Version |
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-
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59104-22-2
Created by
admin on Fri Dec 15 14:58:20 GMT 2023 , Edited by admin on Fri Dec 15 14:58:20 GMT 2023
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SO7S8405GC
Created by
admin on Fri Dec 15 14:58:20 GMT 2023 , Edited by admin on Fri Dec 15 14:58:20 GMT 2023
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PRIMARY | |||
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21499749
Created by
admin on Fri Dec 15 14:58:20 GMT 2023 , Edited by admin on Fri Dec 15 14:58:20 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |