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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H18F2N6OS
Molecular Weight 404.437
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LSN-3226305

SMILES

CC(=O)NC1=CC(=C(F)C=C1)[C@]23CN(C[C@H]2CSC(N)=N3)C4=NC=C(F)C=N4

InChI

InChIKey=JGINUZVVPVJWKP-VOJFVSQTSA-N
InChI=1S/C18H18F2N6OS/c1-10(27)24-13-2-3-15(20)14(4-13)18-9-26(17-22-5-12(19)6-23-17)7-11(18)8-28-16(21)25-18/h2-6,11H,7-9H2,1H3,(H2,21,25)(H,24,27)/t11-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H18F2N6OS
Molecular Weight 404.437
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
8AH9OTE047
Record Status Validated (UNII)
Record Version