U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C17H12OS3
Molecular Weight 328.472
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6-DIMERCAPTO-3,5-DIPHENYL-4H-THIOPYRAN-4-ONE

SMILES

SC1=C(C(=O)C(=C(S)S1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChIKey=SEBANRXRDDGSFC-UHFFFAOYSA-N
InChI=1S/C17H12OS3/c18-15-13(11-7-3-1-4-8-11)16(19)21-17(20)14(15)12-9-5-2-6-10-12/h1-10,19-20H

HIDE SMILES / InChI

Molecular Formula C17H12OS3
Molecular Weight 328.472
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 Sat Dec 16 12:33:13 GMT 2023
Edited
by admin
on Sat Dec 16 12:33:13 GMT 2023
Record UNII
H65Z1J8TR3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,6-DIMERCAPTO-3,5-DIPHENYL-4H-THIOPYRAN-4-ONE
Systematic Name English
3,5-DIPHENYL-2,6-DIMERCAPTO-4H-THIOPYRAN-4-ONE
Systematic Name English
4H-THIOPYRAN-4-ONE, 2,6-DIMERCAPTO-3,5-DIPHENYL-
Systematic Name English
FBS-00831
Code English
NSC-135395
Code English
Code System Code Type Description
NSC
135395
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID50172645
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY
CAS
1913-90-2
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY
PUBCHEM
282209
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY
FDA UNII
H65Z1J8TR3
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY