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Details

Stereochemistry ACHIRAL
Molecular Formula C22H19NO3S
Molecular Weight 377.456
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-((2-AMINOPHENYL)THIO)-3-(1,3-BENZODIOXOL-5-YL)-1-PHENYL-1-PROPANONE

SMILES

NC1=C(SC(CC(=O)C2=CC=CC=C2)C3=CC4=C(OCO4)C=C3)C=CC=C1

InChI

InChIKey=GREKXRGVSVVDFY-UHFFFAOYSA-N
InChI=1S/C22H19NO3S/c23-17-8-4-5-9-21(17)27-22(13-18(24)15-6-2-1-3-7-15)16-10-11-19-20(12-16)26-14-25-19/h1-12,22H,13-14,23H2

HIDE SMILES / InChI

Molecular Formula C22H19NO3S
Molecular Weight 377.456
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:06:35 GMT 2023
Edited
by admin
on Sat Dec 16 13:06:35 GMT 2023
Record UNII
NHH20RDS1K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-((2-AMINOPHENYL)THIO)-3-(1,3-BENZODIOXOL-5-YL)-1-PHENYL-1-PROPANONE
Systematic Name English
1-PROPANONE, 3-((2-AMINOPHENYL)THIO)-3-(1,3-BENZODIOXOL-5-YL)-1-PHENYL-
Systematic Name English
NSC-209908
Code English
Code System Code Type Description
FDA UNII
NHH20RDS1K
Created by admin on Sat Dec 16 13:06:35 GMT 2023 , Edited by admin on Sat Dec 16 13:06:35 GMT 2023
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PUBCHEM
308394
Created by admin on Sat Dec 16 13:06:35 GMT 2023 , Edited by admin on Sat Dec 16 13:06:35 GMT 2023
PRIMARY
NSC
209908
Created by admin on Sat Dec 16 13:06:35 GMT 2023 , Edited by admin on Sat Dec 16 13:06:35 GMT 2023
PRIMARY
CAS
60262-56-8
Created by admin on Sat Dec 16 13:06:35 GMT 2023 , Edited by admin on Sat Dec 16 13:06:35 GMT 2023
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