Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C11H10N3O2S.Ca |
Molecular Weight | 536.64 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=CC=N2.NC3=CC=C(C=C3)S(=O)(=O)[N-]C4=CC=CC=N4
InChI
InChIKey=YXZNOFHFTBDQKU-UHFFFAOYSA-N
InChI=1S/2C11H10N3O2S.Ca/c2*12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11;/h2*1-8H,12H2;/q2*-1;+2
Molecular Formula | Ca |
Molecular Weight | 40.078 |
Charge | 2 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C11H11N3O2S |
Molecular Weight | 249.289 |
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
Sat Dec 16 09:40:06 UTC 2023
by
admin
on
Sat Dec 16 09:40:06 UTC 2023
|
Record UNII |
35HMH7A87O
|
Record Status |
Validated (UNII)
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Record Version |
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-
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4374-96-3
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admin on Sat Dec 16 09:40:06 UTC 2023 , Edited by admin on Sat Dec 16 09:40:06 UTC 2023
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92135670
Created by
admin on Sat Dec 16 09:40:06 UTC 2023 , Edited by admin on Sat Dec 16 09:40:06 UTC 2023
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6101-39-9
Created by
admin on Sat Dec 16 09:40:06 UTC 2023 , Edited by admin on Sat Dec 16 09:40:06 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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35HMH7A87O
Created by
admin on Sat Dec 16 09:40:06 UTC 2023 , Edited by admin on Sat Dec 16 09:40:06 UTC 2023
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DTXSID00365545
Created by
admin on Sat Dec 16 09:40:06 UTC 2023 , Edited by admin on Sat Dec 16 09:40:06 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |