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Details

Stereochemistry ACHIRAL
Molecular Formula C14H11NO3S
Molecular Weight 273.307
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[(4-Nitrophenyl)thio]-1-phenylethanone

SMILES

[O-][N+](=O)C1=CC=C(SCC(=O)C2=CC=CC=C2)C=C1

InChI

InChIKey=MSDOBISTMBKIFE-UHFFFAOYSA-N
InChI=1S/C14H11NO3S/c16-14(11-4-2-1-3-5-11)10-19-13-8-6-12(7-9-13)15(17)18/h1-9H,10H2

HIDE SMILES / InChI

Molecular Formula C14H11NO3S
Molecular Weight 273.307
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 Tue Apr 01 19:49:01 GMT 2025
Edited
by admin
on Tue Apr 01 19:49:01 GMT 2025
Record UNII
8AT9NT5GRC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[(4-Nitrophenyl)thio]-1-phenylethanone
Systematic Name English
NSC-103612
Preferred Name English
p-Nitrophenylthioacetophenone
Systematic Name English
Ethanone, 2-[(4-nitrophenyl)thio]-1-phenyl-
Systematic Name English
Acetophenone, 2-((p-nitrophenyl)thio)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID70186704
Created by admin on Tue Apr 01 19:49:01 GMT 2025 , Edited by admin on Tue Apr 01 19:49:01 GMT 2025
PRIMARY
PUBCHEM
36307
Created by admin on Tue Apr 01 19:49:01 GMT 2025 , Edited by admin on Tue Apr 01 19:49:01 GMT 2025
PRIMARY
NSC
103612
Created by admin on Tue Apr 01 19:49:01 GMT 2025 , Edited by admin on Tue Apr 01 19:49:01 GMT 2025
PRIMARY
FDA UNII
8AT9NT5GRC
Created by admin on Tue Apr 01 19:49:01 GMT 2025 , Edited by admin on Tue Apr 01 19:49:01 GMT 2025
PRIMARY
CAS
33046-48-9
Created by admin on Tue Apr 01 19:49:01 GMT 2025 , Edited by admin on Tue Apr 01 19:49:01 GMT 2025
PRIMARY