Details
Stereochemistry | ACHIRAL |
Molecular Formula | C15H19N5.C7H6O2 |
Molecular Weight | 393.4587 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C1=CC=CC=C1.CN(C)CCC2=[14CH]NC3=CC=C(CN4C=NC=N4)C=C23
InChI
InChIKey=JPRXYLQNJJVCMZ-WJFUWOTKSA-N
InChI=1S/C15H19N5.C7H6O2/c1-19(2)6-5-13-8-17-15-4-3-12(7-14(13)15)9-20-11-16-10-18-20;8-7(9)6-4-2-1-3-5-6/h3-4,7-8,10-11,17H,5-6,9H2,1-2H3;1-5H,(H,8,9)/i8+2;
Molecular Formula | C7H6O2 |
Molecular Weight | 122.1213 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C15H19N5 |
Molecular Weight | 271.3374 |
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 15:34:38 UTC 2023
by
admin
on
Fri Dec 15 15:34:38 UTC 2023
|
Record UNII |
1FDL314JEJ
|
Record Status |
Validated (UNII)
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Record Version |
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-
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145722023
Created by
admin on Fri Dec 15 15:34:38 UTC 2023 , Edited by admin on Fri Dec 15 15:34:38 UTC 2023
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PRIMARY | |||
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1FDL314JEJ
Created by
admin on Fri Dec 15 15:34:38 UTC 2023 , Edited by admin on Fri Dec 15 15:34:38 UTC 2023
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PRIMARY |
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NON-LABELED -> LABELED |