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Details

Stereochemistry ACHIRAL
Molecular Formula C17H16ClNS
Molecular Weight 301.834
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DEMETHYLCHLORPROTHIXENE

SMILES

CNCC\C=C1\C2=CC=CC=C2SC3=C1C=C(Cl)C=C3

InChI

InChIKey=MFNIWJBWDRDXPK-MLPAPPSSSA-N
InChI=1S/C17H16ClNS/c1-19-10-4-6-13-14-5-2-3-7-16(14)20-17-9-8-12(18)11-15(13)17/h2-3,5-9,11,19H,4,10H2,1H3/b13-6-

HIDE SMILES / InChI

Molecular Formula C17H16ClNS
Molecular Weight 301.834
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:41:39 GMT 2023
Edited
by admin
on Sat Dec 16 10:41:39 GMT 2023
Record UNII
6G94400Q0T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEMETHYLCHLORPROTHIXENE
Common Name English
(3Z)-3-(2-chloro-9H-thioxanthen-9-ylidene)-N-methylpropan-1-amine
Systematic Name English
(3Z)-3-(2-CHLORO-9H-THIOXANTHEN-9-YLIDENE)-N-METHYL-1-PROPANAMINE
Systematic Name English
1-PROPANAMINE, 3-(2-CHLORO-9H-THIOXANTHEN-9-YLIDENE)-N-METHYL-, (3Z)-
Systematic Name English
(Z)-N-METHYL-3-(2-CHLORO-9H-THIOXANTHENE-9-YLIDENE)-1-PROPANAMINE
Systematic Name English
CHLORPROTHIXENE HYDROCHLORIDE IMPURITY C [EP IMPURITY]
Common Name English
NORCHLORPROTHIXENE
Common Name English
J730.383A
Code English
Code System Code Type Description
FDA UNII
6G94400Q0T
Created by admin on Sat Dec 16 10:41:39 GMT 2023 , Edited by admin on Sat Dec 16 10:41:39 GMT 2023
PRIMARY
EPA CompTox
DTXSID70789532
Created by admin on Sat Dec 16 10:41:39 GMT 2023 , Edited by admin on Sat Dec 16 10:41:39 GMT 2023
PRIMARY
PUBCHEM
92029501
Created by admin on Sat Dec 16 10:41:39 GMT 2023 , Edited by admin on Sat Dec 16 10:41:39 GMT 2023
PRIMARY
CAS
51382-91-3
Created by admin on Sat Dec 16 10:41:39 GMT 2023 , Edited by admin on Sat Dec 16 10:41:39 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY