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Details

Stereochemistry ACHIRAL
Molecular Formula C19H17N5O2S
Molecular Weight 379.436
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BAY-60-6583

SMILES

NC(=O)CSC1=NC(N)=C(C#N)C(C2=CC=C(OCC3CC3)C=C2)=C1C#N

InChI

InChIKey=ZTYHZMAZUWOXNC-UHFFFAOYSA-N
InChI=1S/C19H17N5O2S/c20-7-14-17(12-3-5-13(6-4-12)26-9-11-1-2-11)15(8-21)19(24-18(14)23)27-10-16(22)25/h3-6,11H,1-2,9-10H2,(H2,22,25)(H2,23,24)

HIDE SMILES / InChI

Molecular Formula C19H17N5O2S
Molecular Weight 379.436
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

Targets

Primary TargetPharmacologyConditionPotency
3.0 nM [EC50]
Substance Class Chemical
Record UNII
UAT5472LHH
Record Status Validated (UNII)
Record Version