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Details

Stereochemistry ACHIRAL
Molecular Formula C18H12F3N5O2
Molecular Weight 387.3154
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2,2-DIFLUOROETHYL)-4-(6-FLUORO-1,3-DIHYDRO-3-OXO-2H-PYRAZOLO(4,3-C)CINNOLIN-2-YL)BENZAMIDE

SMILES

FC(F)CNC(=O)C1=CC=C(C=C1)N2NC3=C(N=NC4=C(F)C=CC=C34)C2=O

InChI

InChIKey=MHFKFNJSUZVGGZ-UHFFFAOYSA-N
InChI=1S/C18H12F3N5O2/c19-12-3-1-2-11-14(12)23-24-16-15(11)25-26(18(16)28)10-6-4-9(5-7-10)17(27)22-8-13(20)21/h1-7,13,25H,8H2,(H,22,27)

HIDE SMILES / InChI
Molecular Formula C18H12F3N5O2
Molecular Weight 387.3154
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86,413
Substance Class Chemical
Record UNII
MNK3B6VR65
Record Status Validated (UNII)
Record Version
NIH
NCATS
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