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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H23ClN2OS2
Molecular Weight 406.992
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Phenothiazine, 2-chloro-10-[[[2-(diethylamino)ethyl]thio]acetyl]-

SMILES

CCN(CC)CCSCC(=O)N1C2=CC(Cl)=CC=C2SC3=C1C=CC=C3

InChI

InChIKey=KTRDLXFZRLYIED-UHFFFAOYSA-N
InChI=1S/C20H23ClN2OS2/c1-3-22(4-2)11-12-25-14-20(24)23-16-7-5-6-8-18(16)26-19-10-9-15(21)13-17(19)23/h5-10,13H,3-4,11-12,14H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C20H23ClN2OS2
Molecular Weight 406.992
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 20:18:24 GMT 2023
Edited
by admin
on Sat Dec 16 20:18:24 GMT 2023
Record UNII
V4QK5S9BQG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Phenothiazine, 2-chloro-10-[[[2-(diethylamino)ethyl]thio]acetyl]-
Systematic Name English
Ethanone, 1-(2-chloro-10H-phenothiazin-10-yl)-2-[[2-(diethylamino)ethyl]thio]-
Systematic Name English
1-(2-Chloro-10H-phenothiazin-10-yl)-2-[[2-(diethylamino)ethyl]thio]ethanone
Systematic Name English
Code System Code Type Description
CAS
4377-17-7
Created by admin on Sat Dec 16 20:18:24 GMT 2023 , Edited by admin on Sat Dec 16 20:18:24 GMT 2023
PRIMARY
FDA UNII
V4QK5S9BQG
Created by admin on Sat Dec 16 20:18:24 GMT 2023 , Edited by admin on Sat Dec 16 20:18:24 GMT 2023
PRIMARY
PUBCHEM
199538
Created by admin on Sat Dec 16 20:18:24 GMT 2023 , Edited by admin on Sat Dec 16 20:18:24 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT