Details
Stereochemistry | ACHIRAL |
Molecular Formula | C16H16ClN5O.ClH.H2O |
Molecular Weight | 384.26 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.CC1(C)CN2C(=N1)N(CC3=CC=C(Cl)C=C3)C4=C(N=CN4)C2=O
InChI
InChIKey=WFFDGXIZQYRZCV-UHFFFAOYSA-N
InChI=1S/C16H16ClN5O.ClH.H2O/c1-16(2)8-22-14(23)12-13(19-9-18-12)21(15(22)20-16)7-10-3-5-11(17)6-4-10;;/h3-6,9H,7-8H2,1-2H3,(H,18,19);1H;1H2
Molecular Formula | C16H16ClN5O |
Molecular Weight | 329.784 |
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 |
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
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 16:02:58 GMT 2023
by
admin
on
Fri Dec 15 16:02:58 GMT 2023
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Record UNII |
6C4UD6155A
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Official Name | English | ||
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Common Name | English | ||
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Code | English | ||
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Code | English | ||
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Common Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C319
Created by
admin on Fri Dec 15 16:02:58 GMT 2023 , Edited by admin on Fri Dec 15 16:02:58 GMT 2023
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Code System | Code | Type | Description | ||
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CHEMBL18531
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admin on Fri Dec 15 16:02:58 GMT 2023 , Edited by admin on Fri Dec 15 16:02:58 GMT 2023
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PRIMARY | |||
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DTXSID10228192
Created by
admin on Fri Dec 15 16:02:58 GMT 2023 , Edited by admin on Fri Dec 15 16:02:58 GMT 2023
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PRIMARY | |||
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S-101
Created by
admin on Fri Dec 15 16:02:58 GMT 2023 , Edited by admin on Fri Dec 15 16:02:58 GMT 2023
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PRIMARY | |||
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77482-47-4
Created by
admin on Fri Dec 15 16:02:58 GMT 2023 , Edited by admin on Fri Dec 15 16:02:58 GMT 2023
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PRIMARY | |||
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23724904
Created by
admin on Fri Dec 15 16:02:58 GMT 2023 , Edited by admin on Fri Dec 15 16:02:58 GMT 2023
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PRIMARY | |||
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6C4UD6155A
Created by
admin on Fri Dec 15 16:02:58 GMT 2023 , Edited by admin on Fri Dec 15 16:02:58 GMT 2023
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PRIMARY | |||
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C81674
Created by
admin on Fri Dec 15 16:02:58 GMT 2023 , Edited by admin on Fri Dec 15 16:02:58 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |