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Details

Stereochemistry ACHIRAL
Molecular Formula C13H9NOS
Molecular Weight 227.282
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Aminothioxanthen-9-one

SMILES

NC1=CC=CC2=C1C(=O)C3=C(S2)C=CC=C3

InChI

InChIKey=ZSSOUAIRYPTMIN-UHFFFAOYSA-N
InChI=1S/C13H9NOS/c14-9-5-3-7-11-12(9)13(15)8-4-1-2-6-10(8)16-11/h1-7H,14H2

HIDE SMILES / InChI

Molecular Formula C13H9NOS
Molecular Weight 227.282
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 12:35:30 GMT 2023
Edited
by admin
on Sat Dec 16 12:35:30 GMT 2023
Record UNII
3PVP97ZX8W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Aminothioxanthen-9-one
Systematic Name English
9H-Thioxanthen-9-one, 1-amino-
Systematic Name English
Thioxanthen-9-one, 1-amino-
Systematic Name English
1-Amino-9H-thioxanthen-9-one
Systematic Name English
Code System Code Type Description
PUBCHEM
3016144
Created by admin on Sat Dec 16 12:35:30 GMT 2023 , Edited by admin on Sat Dec 16 12:35:30 GMT 2023
PRIMARY
FDA UNII
3PVP97ZX8W
Created by admin on Sat Dec 16 12:35:30 GMT 2023 , Edited by admin on Sat Dec 16 12:35:30 GMT 2023
PRIMARY
ECHA (EC/EINECS)
254-753-7
Created by admin on Sat Dec 16 12:35:30 GMT 2023 , Edited by admin on Sat Dec 16 12:35:30 GMT 2023
PRIMARY
CAS
40021-31-6
Created by admin on Sat Dec 16 12:35:30 GMT 2023 , Edited by admin on Sat Dec 16 12:35:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID20193084
Created by admin on Sat Dec 16 12:35:30 GMT 2023 , Edited by admin on Sat Dec 16 12:35:30 GMT 2023
PRIMARY