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Details

Stereochemistry ACHIRAL
Molecular Formula C25H18FN5O4S3
Molecular Weight 567.635
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AUM-302

SMILES

COC1=NC=C2C=C1NS(=O)(=O)C3=CC=C(F)C(=C3)C(=O)NCC4=CC=C(S4)C5=NC=NC6=C5SC2=C6C

InChI

InChIKey=WHJIHZSXTQRCNX-UHFFFAOYSA-N
InChI=1S/C25H18FN5O4S3/c1-12-20-23-21(30-11-29-20)19-6-3-14(36-19)10-27-24(32)16-8-15(4-5-17(16)26)38(33,34)31-18-7-13(22(12)37-23)9-28-25(18)35-2/h3-9,11,31H,10H2,1-2H3,(H,27,32)

HIDE SMILES / InChI

Molecular Formula C25H18FN5O4S3
Molecular Weight 567.635
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
F7WQK85U32
Record Status Validated (UNII)
Record Version