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Details

Stereochemistry ACHIRAL
Molecular Formula C22H18N2O2S
Molecular Weight 374.456
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of R-16

SMILES

CN(C)CCN1C(=O)C2=CC3=C(SC4=CC=CC=C34)C5=CC=CC(C1=O)=C25

InChI

InChIKey=SYGWYBOJXOGMRU-UHFFFAOYSA-N
InChI=1S/C22H18N2O2S/c1-23(2)10-11-24-21(25)15-8-5-7-14-19(15)17(22(24)26)12-16-13-6-3-4-9-18(13)27-20(14)16/h3-9,12H,10-11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C22H18N2O2S
Molecular Weight 374.456
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 14:03:50 UTC 2023
Edited
by admin
on Thu Jul 06 14:03:50 UTC 2023
Record UNII
99TC0Y7HIR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
R-16
Code English
4H-BENZO(DE)(1)BENZOTHIENO(2,3-G)ISOQUINOLINE-4,6(5H)-DIONE, 5-(2-(DIMETHYLAMINO)ETHYL)-
Systematic Name English
R16
Code English
Code System Code Type Description
FDA UNII
99TC0Y7HIR
Created by admin on Thu Jul 06 14:03:50 UTC 2023 , Edited by admin on Thu Jul 06 14:03:50 UTC 2023
PRIMARY
PUBCHEM
16059812
Created by admin on Thu Jul 06 14:03:50 UTC 2023 , Edited by admin on Thu Jul 06 14:03:50 UTC 2023
PRIMARY
CAS
791590-89-1
Created by admin on Thu Jul 06 14:03:50 UTC 2023 , Edited by admin on Thu Jul 06 14:03:50 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
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ACTIVE MOIETY