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Details

Stereochemistry ACHIRAL
Molecular Formula C30H29F6N5O3
Molecular Weight 621.5734
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KRP-103

SMILES

CC(=O)N1CCN(CC1)C2=NC(C3=CC=CC=C3C)=C4C(OCCCN(CC5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F)C4=O)=N2

InChI

InChIKey=NCPKXVSLLSEPDP-UHFFFAOYSA-N
InChI=1S/C30H29F6N5O3/c1-18-6-3-4-7-23(18)25-24-26(38-28(37-25)40-11-9-39(10-12-40)19(2)42)44-13-5-8-41(27(24)43)17-20-14-21(29(31,32)33)16-22(15-20)30(34,35)36/h3-4,6-7,14-16H,5,8-13,17H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C30H29F6N5O3
Molecular Weight 621.5734
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
S8332LV592
Record Status Validated (UNII)
Record Version