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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H28N2O5S
Molecular Weight 504.597
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PNU-103265

SMILES

OC1=C([C@@H](C2CC2)C3=CC(NS(=O)(=O)C4=CC=C(C=C4)C#N)=CC=C3)C(=O)OC5=C1CCCCCC5

InChI

InChIKey=VCYQENLVFRTJIC-VWLOTQADSA-N
InChI=1S/C28H28N2O5S/c29-17-18-10-14-22(15-11-18)36(33,34)30-21-7-5-6-20(16-21)25(19-12-13-19)26-27(31)23-8-3-1-2-4-9-24(23)35-28(26)32/h5-7,10-11,14-16,19,25,30-31H,1-4,8-9,12-13H2/t25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H28N2O5S
Molecular Weight 504.597
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:59:48 GMT 2023
Edited
by admin
on Sat Dec 16 13:59:48 GMT 2023
Record UNII
NZ85DS1SMJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PNU-103265
Code English
4-CYANO-N-(3-((S)-CYCLOPROPYL(5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY-2-OXO-2H-CYCLOOCTA(B)PYRAN-3-YL)METHYL)PHENYL)BENZENESULFONAMIDE
Systematic Name English
BENZENESULFONAMIDE, 4-CYANO-N-(3-((S)-CYCLOPROPYL(5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY-2-OXO-2H-CYCLOOCTA(B)PYRAN-3-YL)METHYL)PHENYL)-
Systematic Name English
PNU-103017, (-)-
Code English
Code System Code Type Description
FDA UNII
NZ85DS1SMJ
Created by admin on Sat Dec 16 13:59:48 GMT 2023 , Edited by admin on Sat Dec 16 13:59:48 GMT 2023
PRIMARY
PUBCHEM
54688879
Created by admin on Sat Dec 16 13:59:48 GMT 2023 , Edited by admin on Sat Dec 16 13:59:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID30169533
Created by admin on Sat Dec 16 13:59:48 GMT 2023 , Edited by admin on Sat Dec 16 13:59:48 GMT 2023
PRIMARY
CAS
173140-87-9
Created by admin on Sat Dec 16 13:59:48 GMT 2023 , Edited by admin on Sat Dec 16 13:59:48 GMT 2023
PRIMARY
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