Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C18H21IN6O2S.ClH |
| Molecular Weight | 548.829 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC(C)NCCCN1C(SC2=C(I)C=C3OCOC3=C2)=NC4=C(N)N=CN=C14
InChI
InChIKey=HUAKDRZHOBLKGD-UHFFFAOYSA-N
InChI=1S/C18H21IN6O2S.ClH/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13;/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23);1H
| Molecular Formula | C18H21IN6O2S |
| Molecular Weight | 512.368 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:57:45 UTC 2023
by
admin
on
Sat Dec 16 15:57:45 UTC 2023
|
| Record UNII |
WHT95Y619Y
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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54613037
Created by
admin on Sat Dec 16 15:57:45 UTC 2023 , Edited by admin on Sat Dec 16 15:57:45 UTC 2023
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PRIMARY | |||
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WHT95Y619Y
Created by
admin on Sat Dec 16 15:57:45 UTC 2023 , Edited by admin on Sat Dec 16 15:57:45 UTC 2023
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PRIMARY | |||
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2095432-24-7
Created by
admin on Sat Dec 16 15:57:45 UTC 2023 , Edited by admin on Sat Dec 16 15:57:45 UTC 2023
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PRIMARY | |||
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2094036-90-3
Created by
admin on Sat Dec 16 15:57:45 UTC 2023 , Edited by admin on Sat Dec 16 15:57:45 UTC 2023
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NON-SPECIFIC STOICHIOMETRY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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