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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H10O2S3
Molecular Weight 318.434
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 10-methyl-4-phenyl-11-oxa-5,6lambda4,7-trithiatricyclo[6.4.0.0{2,6}]dodeca-1(8),2(6),3,9-tetraen-12-one

SMILES

CC1=CC2=C(C3=S(SC(=C3)C4=CC=CC=C4)S2)C(=O)O1

InChI

InChIKey=XQXVZLATYFMXSP-UHFFFAOYSA-N
InChI=1S/C15H10O2S3/c1-9-7-12-14(15(16)17-9)13-8-11(18-20(13)19-12)10-5-3-2-4-6-10/h2-8H,1H3

HIDE SMILES / InChI

Molecular Formula C15H10O2S3
Molecular Weight 318.434
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 19:15:51 GMT 2023
Edited
by admin
on Sat Dec 16 19:15:51 GMT 2023
Record UNII
MF9QKQ6Z4J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
10-methyl-4-phenyl-11-oxa-5,6lambda4,7-trithiatricyclo[6.4.0.0{2,6}]dodeca-1(8),2(6),3,9-tetraen-12-one
Systematic Name English
6-METHYL-2-PHENYL-4H-9LAMBDA(4)-(1,2)DITHIOLO(5',1':5,1)(1,2)DITHIOLO(4,3-C)PYRAN-4-ONE
Common Name English
NSC-294104
Code English
4H-9λ4-[1,2]Dithiolo[1′,5′:1,5][1,2]dithiolo[4,3-c]pyran-4-one, 6-methyl-2-phenyl-
Systematic Name English
Code System Code Type Description
NSC
294104
Created by admin on Sat Dec 16 19:15:51 GMT 2023 , Edited by admin on Sat Dec 16 19:15:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID40987028
Created by admin on Sat Dec 16 19:15:51 GMT 2023 , Edited by admin on Sat Dec 16 19:15:51 GMT 2023
PRIMARY
PUBCHEM
325384
Created by admin on Sat Dec 16 19:15:51 GMT 2023 , Edited by admin on Sat Dec 16 19:15:51 GMT 2023
PRIMARY
FDA UNII
MF9QKQ6Z4J
Created by admin on Sat Dec 16 19:15:51 GMT 2023 , Edited by admin on Sat Dec 16 19:15:51 GMT 2023
PRIMARY
CAS
67668-14-8
Created by admin on Sat Dec 16 19:15:51 GMT 2023 , Edited by admin on Sat Dec 16 19:15:51 GMT 2023
PRIMARY