Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H16ClN5O2.H2O4S |
| Molecular Weight | 479.894 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.C[C@@H](OC1=NN=C(N1C)C2=CC=NC=C2)C3=NOC(=C3)C4=CC(Cl)=CC=C4
InChI
InChIKey=AXINWMMNESJNKJ-UTONKHPSSA-N
InChI=1S/C19H16ClN5O2.H2O4S/c1-12(16-11-17(27-24-16)14-4-3-5-15(20)10-14)26-19-23-22-18(25(19)2)13-6-8-21-9-7-13;1-5(2,3)4/h3-12H,1-2H3;(H2,1,2,3,4)/t12-;/m1./s1
| Molecular Formula | H2O4S |
| Molecular Weight | 98.078 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C19H16ClN5O2 |
| Molecular Weight | 381.816 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:28:57 UTC 2023
by
admin
on
Sat Dec 16 01:28:57 UTC 2023
|
| Record UNII |
BJQ70YX51S
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Code | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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934282-57-2
Created by
admin on Sat Dec 16 01:28:57 UTC 2023 , Edited by admin on Sat Dec 16 01:28:57 UTC 2023
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BJQ70YX51S
Created by
admin on Sat Dec 16 01:28:57 UTC 2023 , Edited by admin on Sat Dec 16 01:28:57 UTC 2023
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PRIMARY | |||
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69007598
Created by
admin on Sat Dec 16 01:28:57 UTC 2023 , Edited by admin on Sat Dec 16 01:28:57 UTC 2023
|
PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |