Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H21FN6O3 |
Molecular Weight | 424.4282 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CNCC1=NN(C)C(C#N)=C1C2=CN=C(N)C(O[C@H](C)C3=CC(F)=CC=C3C(O)=O)=C2
InChI
InChIKey=IFEPJAKXCDYTOK-LLVKDONJSA-N
InChI=1S/C21H21FN6O3/c1-11(15-7-13(22)4-5-14(15)21(29)30)31-18-6-12(9-26-20(18)24)19-16(10-25-2)27-28(3)17(19)8-23/h4-7,9,11,25H,10H2,1-3H3,(H2,24,26)(H,29,30)/t11-/m1/s1
Approval Year
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89816280
Created by
admin on Sat Dec 16 14:56:45 GMT 2023 , Edited by admin on Sat Dec 16 14:56:45 GMT 2023
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1455009-85-4
Created by
admin on Sat Dec 16 14:56:45 GMT 2023 , Edited by admin on Sat Dec 16 14:56:45 GMT 2023
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FSA26J9M8B
Created by
admin on Sat Dec 16 14:56:45 GMT 2023 , Edited by admin on Sat Dec 16 14:56:45 GMT 2023
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PRIMARY |
PARENT (METABOLITE INACTIVE)
SUBSTANCE RECORD