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Details

Stereochemistry ACHIRAL
Molecular Formula C21H17F4N5O3S
Molecular Weight 495.45
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(8-(3-Fluoro-4-(methylcarbamoyl)phenyl)-5-oxo-7-thioxo-6,8-diazaspiro(3.4)octan-6-yl)-3-(trifluoromethyl)pyridine-2-carboxamide

SMILES

CNC(=O)C1=CC=C(C=C1F)N2C(=S)N(C(=O)C23CCC3)C4=CC(=C(N=C4)C(N)=O)C(F)(F)F

InChI

InChIKey=VUCVAUCRZQRWAV-UHFFFAOYSA-N
InChI=1S/C21H17F4N5O3S/c1-27-17(32)12-4-3-10(8-14(12)22)30-19(34)29(18(33)20(30)5-2-6-20)11-7-13(21(23,24)25)15(16(26)31)28-9-11/h3-4,7-9H,2,5-6H2,1H3,(H2,26,31)(H,27,32)

HIDE SMILES / InChI

Molecular Formula C21H17F4N5O3S
Molecular Weight 495.45
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
MV57FQG9XK
Record Status Validated (UNII)
Record Version