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Details

Stereochemistry UNKNOWN
Molecular Formula C15H16N4O2
Molecular Weight 284.3131
Optical Activity ( - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NICARAVEN, (-)-

SMILES

CC(CNC(=O)C1=CC=CN=C1)NC(=O)C2=CN=CC=C2

InChI

InChIKey=KTXBOOWDLPUROC-UHFFFAOYSA-N
InChI=1S/C15H16N4O2/c1-11(19-15(21)13-5-3-7-17-10-13)8-18-14(20)12-4-2-6-16-9-12/h2-7,9-11H,8H2,1H3,(H,18,20)(H,19,21)

HIDE SMILES / InChI

Molecular Formula C15H16N4O2
Molecular Weight 284.3131
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
K13EV3J70Q
Record Status Validated (UNII)
Record Version