Details
Stereochemistry | ACHIRAL |
Molecular Formula | C12H13BrN4O2S |
Molecular Weight | 357.226 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=NC(NS(=O)(=O)C2=CC=C(N)C=C2)=NC(C)=C1Br
InChI
InChIKey=KWXCNODTHBHSIQ-UHFFFAOYSA-N
InChI=1S/C12H13BrN4O2S/c1-7-11(13)8(2)16-12(15-7)17-20(18,19)10-5-3-9(14)4-6-10/h3-6H,14H2,1-2H3,(H,15,16,17)
Molecular Formula | C12H13BrN4O2S |
Molecular Weight | 357.226 |
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 15:08:41 UTC 2023
by
admin
on
Fri Dec 15 15:08:41 UTC 2023
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Record UNII |
PQK2N461KJ
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Record Status |
Validated (UNII)
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Record Version |
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-
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Common Name | English | ||
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Systematic Name | English | ||
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Common Name | English | ||
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Code | English |
Classification Tree | Code System | Code | ||
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CFR |
21 CFR 520.2170
Created by
admin on Fri Dec 15 15:08:41 UTC 2023 , Edited by admin on Fri Dec 15 15:08:41 UTC 2023
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NCI_THESAURUS |
C29739
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admin on Fri Dec 15 15:08:41 UTC 2023 , Edited by admin on Fri Dec 15 15:08:41 UTC 2023
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8310
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C80792
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m10300
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PRIMARY | Merck Index | ||
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116-45-0
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204-142-6
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DTXSID5046857
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5874
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DB11547
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PQK2N461KJ
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admin on Fri Dec 15 15:08:41 UTC 2023 , Edited by admin on Fri Dec 15 15:08:41 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT | |||
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SALT/SOLVATE -> PARENT |
Related Record | Type | Details | ||
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ACTIVE MOIETY |