Details
Stereochemistry | ACHIRAL |
Molecular Formula | C20H16ClN5O3.CH4O3S |
Molecular Weight | 505.931 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CNC(=O)C1=NC=CC(COC2=NN=C(NC3=CC=C(Cl)C=C3)C4=C2OC=C4)=C1
InChI
InChIKey=LCMLACPWPXITHP-UHFFFAOYSA-N
InChI=1S/C20H16ClN5O3.CH4O3S/c1-22-19(27)16-10-12(6-8-23-16)11-29-20-17-15(7-9-28-17)18(25-26-20)24-14-4-2-13(21)3-5-14;1-5(2,3)4/h2-10H,11H2,1H3,(H,22,27)(H,24,25);1H3,(H,2,3,4)
Molecular Formula | C20H16ClN5O3 |
Molecular Weight | 409.826 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:26:27 UTC 2023
by
admin
on
Fri Dec 15 16:26:27 UTC 2023
|
Record UNII |
571LVA9UMS
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Name | Type | Language | ||
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Common Name | English | ||
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Systematic Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1742
Created by
admin on Fri Dec 15 16:26:27 UTC 2023 , Edited by admin on Fri Dec 15 16:26:27 UTC 2023
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NCI_THESAURUS |
C129825
Created by
admin on Fri Dec 15 16:26:27 UTC 2023 , Edited by admin on Fri Dec 15 16:26:27 UTC 2023
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NCI_THESAURUS |
C1967
Created by
admin on Fri Dec 15 16:26:27 UTC 2023 , Edited by admin on Fri Dec 15 16:26:27 UTC 2023
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Code System | Code | Type | Description | ||
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571LVA9UMS
Created by
admin on Fri Dec 15 16:26:27 UTC 2023 , Edited by admin on Fri Dec 15 16:26:27 UTC 2023
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PRIMARY | |||
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C87837
Created by
admin on Fri Dec 15 16:26:27 UTC 2023 , Edited by admin on Fri Dec 15 16:26:27 UTC 2023
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PRIMARY | |||
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332013-26-0
Created by
admin on Fri Dec 15 16:26:27 UTC 2023 , Edited by admin on Fri Dec 15 16:26:27 UTC 2023
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PRIMARY | |||
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9870815
Created by
admin on Fri Dec 15 16:26:27 UTC 2023 , Edited by admin on Fri Dec 15 16:26:27 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |