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Details

Stereochemistry ACHIRAL
Molecular Formula C15H11F3N4O2
Molecular Weight 336.2686
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RU-58642

SMILES

CC1(C)N(CC#N)C(=O)N(C1=O)C2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChIKey=ZVWXHSNUBLIKJH-UHFFFAOYSA-N
InChI=1S/C15H11F3N4O2/c1-14(2)12(23)22(13(24)21(14)6-5-19)10-4-3-9(8-20)11(7-10)15(16,17)18/h3-4,7H,6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C15H11F3N4O2
Molecular Weight 336.2686
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

Substance Class Chemical
Record UNII
DX44GS85HK
Record Status Validated (UNII)
Record Version