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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H16F2N6S
Molecular Weight 362.4
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LSN-3200635

SMILES

[H][C@@]12CN(C[C@@]1(N=C(N)SC2)C3=CC(N)=CC=C3F)C4=NC=C(F)C=N4

InChI

InChIKey=ZCEKPVXATMBLCW-FVMDXXJSSA-N
InChI=1S/C16H16F2N6S/c17-10-4-21-15(22-5-10)24-6-9-7-25-14(20)23-16(9,8-24)12-3-11(19)1-2-13(12)18/h1-5,9H,6-8,19H2,(H2,20,23)/t9-,16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H16F2N6S
Molecular Weight 362.4
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:11:04 GMT 2023
Edited
by admin
on Sat Dec 16 16:11:04 GMT 2023
Record UNII
9GF89N1FRF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LSN-3200635
Code English
(4AR,7AS)-7A-(5-AMINO-2-FLUOROPHENYL)-6-(5-FLUORO-2-PYRIMIDINYL)-4,4A,5,6,7,7A-HEXAHYDROPYRROLO(3,4-D)(1,3)THIAZIN-2-AMINE
Systematic Name English
LSN3200635
Code English
LY3202626 METABOLITE M1
Common Name English
PYRROLO(3,4-D)(1,3)THIAZIN-2-AMINE, 7A-(5-AMINO-2-FLUOROPHENYL)-6-(5-FLUORO-2-PYRIMIDINYL)-4,4A,5,6,7,7A-HEXAHYDRO-, (4AR,7AS)-
Systematic Name English
Code System Code Type Description
CAS
1889273-50-0
Created by admin on Sat Dec 16 16:11:04 GMT 2023 , Edited by admin on Sat Dec 16 16:11:04 GMT 2023
PRIMARY
PUBCHEM
118961665
Created by admin on Sat Dec 16 16:11:04 GMT 2023 , Edited by admin on Sat Dec 16 16:11:04 GMT 2023
PRIMARY
FDA UNII
9GF89N1FRF
Created by admin on Sat Dec 16 16:11:04 GMT 2023 , Edited by admin on Sat Dec 16 16:11:04 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
URINE
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PLASMA