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Details

Stereochemistry ACHIRAL
Molecular Formula C22H23FN6OS
Molecular Weight 438.521
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MAX-40279

SMILES

COC1=CC(F)=CC=C1C2=C(C)SC3=CN=C(NC4=CN(N=C4)C5CCNCC5)N=C23

InChI

InChIKey=AVIOBQFPAGEICQ-UHFFFAOYSA-N
InChI=1S/C22H23FN6OS/c1-13-20(17-4-3-14(23)9-18(17)30-2)21-19(31-13)11-25-22(28-21)27-15-10-26-29(12-15)16-5-7-24-8-6-16/h3-4,9-12,16,24H,5-8H2,1-2H3,(H,25,27,28)

HIDE SMILES / InChI

Molecular Formula C22H23FN6OS
Molecular Weight 438.521
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
DL772G3NN7
Record Status Validated (UNII)
Record Version