Details
Stereochemistry | ACHIRAL |
Molecular Formula | C15H17FN4O2.C4H4O4 |
Molecular Weight | 420.3916 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CCOC(=O)NC1=C(N)N=C(NCC2=CC=C(F)C=C2)C=C1
InChI
InChIKey=DPYIXBFZUMCMJM-BTJKTKAUSA-N
InChI=1S/C15H17FN4O2.C4H4O4/c1-2-22-15(21)19-12-7-8-13(20-14(12)17)18-9-10-3-5-11(16)6-4-10;5-3(6)1-2-4(7)8/h3-8H,2,9H2,1H3,(H,19,21)(H3,17,18,20);1-2H,(H,5,6)(H,7,8)/b;2-1-
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Molecular Formula | C15H17FN4O2 |
Molecular Weight | 304.3195 |
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 16:21:10 UTC 2023
by
admin
on
Fri Dec 15 16:21:10 UTC 2023
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Record UNII |
0VCI53PK4A
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Record Status |
Validated (UNII)
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Record Version |
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-
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Code | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C241
Created by
admin on Fri Dec 15 16:21:10 UTC 2023 , Edited by admin on Fri Dec 15 16:21:10 UTC 2023
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Code System | Code | Type | Description | ||
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m5491
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PRIMARY | Merck Index | ||
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C72785
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278-225-0
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75507-68-5
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236774
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admin on Fri Dec 15 16:21:10 UTC 2023 , Edited by admin on Fri Dec 15 16:21:10 UTC 2023
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PRIMARY | RxNorm | ||
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W-19
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100000086994
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DTXSID8045771
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6435335
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CHEMBL255044
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DBSALT000912
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SUB02234MIG
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0VCI53PK4A
Created by
admin on Fri Dec 15 16:21:10 UTC 2023 , Edited by admin on Fri Dec 15 16:21:10 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |