Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C15H19N5O.C7H8O3S |
| Molecular Weight | 457.546 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.C[C@H]2CC[C@H](CN2C(=O)C=C)NC3=C4C=CNC4=NC=N3
InChI
InChIKey=YOZLVAFWYLSRRN-VZXYPILPSA-N
InChI=1S/C15H19N5O.C7H8O3S/c1-3-13(21)20-8-11(5-4-10(20)2)19-15-12-6-7-16-14(12)17-9-18-15;1-6-2-4-7(5-3-6)11(8,9)10/h3,6-7,9-11H,1,4-5,8H2,2H3,(H2,16,17,18,19);2-5H,1H3,(H,8,9,10)/t10-,11+;/m0./s1
| Molecular Formula | C15H19N5O |
| Molecular Weight | 285.3443 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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 17:26:45 UTC 2023
by
admin
on
Fri Dec 15 17:26:45 UTC 2023
|
| Record UNII |
EAG4T1459K
|
| 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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300000045469
Created by
admin on Fri Dec 15 17:26:45 UTC 2023 , Edited by admin on Fri Dec 15 17:26:45 UTC 2023
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PRIMARY | |||
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145722621
Created by
admin on Fri Dec 15 17:26:45 UTC 2023 , Edited by admin on Fri Dec 15 17:26:45 UTC 2023
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EAG4T1459K
Created by
admin on Fri Dec 15 17:26:45 UTC 2023 , Edited by admin on Fri Dec 15 17:26:45 UTC 2023
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2192215-81-7
Created by
admin on Fri Dec 15 17:26:45 UTC 2023 , Edited by admin on Fri Dec 15 17:26:45 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |
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