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Details

Stereochemistry RACEMIC
Molecular Formula C21H28ClN3O4S
Molecular Weight 453.983
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PRX-07034 FREE BASE

SMILES

COC1=C(OC)C(=CC(Cl)=C1)C(C)NC2=CC(=CC=C2S(C)(=O)=O)N3CCNCC3

InChI

InChIKey=BSLXKMCHXRCBIH-UHFFFAOYSA-N
InChI=1S/C21H28ClN3O4S/c1-14(17-11-15(22)12-19(28-2)21(17)29-3)24-18-13-16(25-9-7-23-8-10-25)5-6-20(18)30(4,26)27/h5-6,11-14,23-24H,7-10H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C21H28ClN3O4S
Molecular Weight 453.983
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
4.0 nM [Ki]
Substance Class Chemical
Record UNII
YJ5TMF911R
Record Status Validated (UNII)
Record Version