Details
Stereochemistry | RACEMIC |
Molecular Formula | C17H20N2S.C7H7ClN4O2 |
Molecular Weight | 499.028 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1C2=C(NC(Cl)=N2)C(=O)N(C)C1=O.CC(CN3C4=CC=CC=C4SC5=C3C=CC=C5)N(C)C
InChI
InChIKey=YCXARMXCESBEDS-UHFFFAOYSA-N
InChI=1S/C17H20N2S.C7H7ClN4O2/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19;1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h4-11,13H,12H2,1-3H3;1-2H3,(H,9,10)
Molecular Formula | C17H20N2S |
Molecular Weight | 284.419 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | C7H7ClN4O2 |
Molecular Weight | 214.609 |
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 15:28:59 UTC 2023
by
admin
on
Fri Dec 15 15:28:59 UTC 2023
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Record UNII |
S5PUP23U26
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29756
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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NCI_THESAURUS |
C740
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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Code System | Code | Type | Description | ||
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241-691-0
Created by
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PRIMARY | |||
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63030
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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100000081127
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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860
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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SUB10089MIG
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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S5PUP23U26
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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PRIMARY | |||
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C66479
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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m9171
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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PRIMARY | Merck Index | ||
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17693-51-5
Created by
admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |