Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C19H16N8O.CH4O3S |
| Molecular Weight | 468.489 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.OCCN1C=C(C=N1)C2=CN=C3N=NN(CC4=CC=C5N=CC=CC5=C4)C3=N2
InChI
InChIKey=HBEMHKVWZJTVOC-UHFFFAOYSA-N
InChI=1S/C19H16N8O.CH4O3S/c28-7-6-26-12-15(9-22-26)17-10-21-18-19(23-17)27(25-24-18)11-13-3-4-16-14(8-13)2-1-5-20-16;1-5(2,3)4/h1-5,8-10,12,28H,6-7,11H2;1H3,(H,2,3,4)
| Molecular Formula | CH4O3S |
| Molecular Weight | 96.106 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C19H16N8O |
| Molecular Weight | 372.3833 |
| 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 08:15:06 UTC 2023
by
admin
on
Sat Dec 16 08:15:06 UTC 2023
|
| Record UNII |
149X53W31J
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
Download
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DTXSID80647715
Created by
admin on Sat Dec 16 08:15:06 UTC 2023 , Edited by admin on Sat Dec 16 08:15:06 UTC 2023
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149X53W31J
Created by
admin on Sat Dec 16 08:15:06 UTC 2023 , Edited by admin on Sat Dec 16 08:15:06 UTC 2023
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956906-93-7
Created by
admin on Sat Dec 16 08:15:06 UTC 2023 , Edited by admin on Sat Dec 16 08:15:06 UTC 2023
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24852079
Created by
admin on Sat Dec 16 08:15:06 UTC 2023 , Edited by admin on Sat Dec 16 08:15:06 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |