Details
Stereochemistry | ACHIRAL |
Molecular Formula | C21H22BrN5O3 |
Molecular Weight | 472.335 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(CCCCNC2=NC(=O)C(CC3=CN=C(C=C3)C(O)=O)=CN2)N=CC(Br)=C1
InChI
InChIKey=LQPKWLSQJLCYSN-UHFFFAOYSA-N
InChI=1S/C21H22BrN5O3/c1-13-8-16(22)12-25-17(13)4-2-3-7-23-21-26-11-15(19(28)27-21)9-14-5-6-18(20(29)30)24-10-14/h5-6,8,10-12H,2-4,7,9H2,1H3,(H,29,30)(H2,23,26,27,28)
Molecular Formula | C21H22BrN5O3 |
Molecular Weight | 472.335 |
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
Sat Dec 16 15:39:20 GMT 2023
by
admin
on
Sat Dec 16 15:39:20 GMT 2023
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Record UNII |
C0ZWX7SA7K
|
Record Status |
Validated (UNII)
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Record Version |
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-
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146014888
Created by
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C0ZWX7SA7K
Created by
admin on Sat Dec 16 15:39:21 GMT 2023 , Edited by admin on Sat Dec 16 15:39:21 GMT 2023
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130177-38-7
Created by
admin on Sat Dec 16 15:39:21 GMT 2023 , Edited by admin on Sat Dec 16 15:39:21 GMT 2023
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