Details
Stereochemistry | RACEMIC |
Molecular Formula | C17H13ClN4.ClH |
Molecular Weight | 345.226 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.ClC1=CC=CC(=C1)C(N2C=CN=C2)C3=CC=C4N=CNC4=C3
InChI
InChIKey=OTSZCHORPMQCBZ-UHFFFAOYSA-N
InChI=1S/C17H13ClN4.ClH/c18-14-3-1-2-12(8-14)17(22-7-6-19-11-22)13-4-5-15-16(9-13)21-10-20-15;/h1-11,17H,(H,20,21);1H
Molecular Formula | C17H13ClN4 |
Molecular Weight | 308.765 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
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
Fri Dec 15 15:30:10 UTC 2023
by
admin
on
Fri Dec 15 15:30:10 UTC 2023
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Record UNII |
29T7S2IB97
|
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 |
C2018
Created by
admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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Code System | Code | Type | Description | ||
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C061121
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145858-50-0
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admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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C80333
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admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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DTXSID9046817
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71454
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100000086148
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CHEMBL389433
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admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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FF-46
Created by
admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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m6798
Created by
admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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PRIMARY | Merck Index | ||
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SUB02919MIG
Created by
admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 UTC 2023
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29T7S2IB97
Created by
admin on Fri Dec 15 15:30:10 UTC 2023 , Edited by admin on Fri Dec 15 15:30:10 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 |