Details
Stereochemistry | ACHIRAL |
Molecular Formula | C12H13N5O2S.ClH |
Molecular Weight | 327.79 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.NC1=CC(N)=C(C=C1)N=NC2=CC=C(C=C2)S(N)(=O)=O
InChI
InChIKey=GMGDMWHAFYNGFF-CMBBICFISA-N
InChI=1S/C12H13N5O2S.ClH/c13-8-1-6-12(11(14)7-8)17-16-9-2-4-10(5-3-9)20(15,18)19;/h1-7H,13-14H2,(H2,15,18,19);1H/b17-16+;
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C12H13N5O2S |
Molecular Weight | 291.329 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:58:08 UTC 2023
by
admin
on
Sat Dec 16 08:58:08 UTC 2023
|
Record UNII |
2N9562JWVL
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Code System | Code | Type | Description | ||
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33445-35-1
Created by
admin on Sat Dec 16 08:58:08 UTC 2023 , Edited by admin on Sat Dec 16 08:58:08 UTC 2023
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DTXSID30187090
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admin on Sat Dec 16 08:58:08 UTC 2023 , Edited by admin on Sat Dec 16 08:58:08 UTC 2023
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8464
Created by
admin on Sat Dec 16 08:58:08 UTC 2023 , Edited by admin on Sat Dec 16 08:58:08 UTC 2023
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2N9562JWVL
Created by
admin on Sat Dec 16 08:58:08 UTC 2023 , Edited by admin on Sat Dec 16 08:58:08 UTC 2023
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m10325
Created by
admin on Sat Dec 16 08:58:08 UTC 2023 , Edited by admin on Sat Dec 16 08:58:08 UTC 2023
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PRIMARY | Merck Index | ||
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71954678
Created by
admin on Sat Dec 16 08:58:08 UTC 2023 , Edited by admin on Sat Dec 16 08:58:08 UTC 2023
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Related Record | Type | Details | ||
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METABOLITE -> PARENT |
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METABOLITE -> PARENT |