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Details

Stereochemistry RACEMIC
Molecular Formula C16H18N2S
Molecular Weight 270.393
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-DEMETHYLPROMETHAZINE

SMILES

CNC(C)CN1C2=CC=CC=C2SC3=C1C=CC=C3

InChI

InChIKey=IJOZCCILCJIHOA-UHFFFAOYSA-N
InChI=1S/C16H18N2S/c1-12(17-2)11-18-13-7-3-5-9-15(13)19-16-10-6-4-8-14(16)18/h3-10,12,17H,11H2,1-2H3

HIDE SMILES / InChI
Molecular Formula C16H18N2S
Molecular Weight 270.393
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:01:07 UTC 2023
Edited
by admin
on Sat Dec 16 08:01:07 UTC 2023
Record UNII
906QAW7T4F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-DEMETHYLPROMETHAZINE
Common Name English
NOR1-PROMETHAZINE
Common Name English
MONODESMETHYLPROMETHAZINE
Common Name English
N-DEMETHYLPROMETHAZINE, (±)-
Common Name English
N-DESMETHYLPROMETHAZINE
Common Name English
(2RS)-N-METHYL-1-(10H-PHENOTHIAZIN-10-YL)PROPAN-2-AMINE
Systematic Name English
PROMETHAZINE HYDROCHLORIDE IMPURITY C [EP IMPURITY]
Common Name English
10H-PHENOTHIAZINE-10-ETHANAMINE, N,.ALPHA.-DIMETHYL-
Systematic Name English
Code System Code Type Description
SMS_ID
100000167202
Created by admin on Sat Dec 16 08:01:07 UTC 2023 , Edited by admin on Sat Dec 16 08:01:07 UTC 2023
PRIMARY
EPA CompTox
DTXSID90958743
Created by admin on Sat Dec 16 08:01:07 UTC 2023 , Edited by admin on Sat Dec 16 08:01:07 UTC 2023
PRIMARY
CAS
37707-23-6
Created by admin on Sat Dec 16 08:01:07 UTC 2023 , Edited by admin on Sat Dec 16 08:01:07 UTC 2023
PRIMARY
PUBCHEM
169959
Created by admin on Sat Dec 16 08:01:07 UTC 2023 , Edited by admin on Sat Dec 16 08:01:07 UTC 2023
PRIMARY
FDA UNII
906QAW7T4F
Created by admin on Sat Dec 16 08:01:07 UTC 2023 , Edited by admin on Sat Dec 16 08:01:07 UTC 2023
PRIMARY
EVMPD
SUB181606
Created by admin on Sat Dec 16 08:01:07 UTC 2023 , Edited by admin on Sat Dec 16 08:01:07 UTC 2023
PRIMARY
Related Record Type Details
Structure of N-DEMETHYLPROMETHAZINE, (S)-
ENANTIOMER -> RACEMATE
Structure of N-DEMETHYLPROMETHAZINE, (R)-
ENANTIOMER -> RACEMATE
Related Record Type Details
Structure of PROMETHAZINE HIBENZATE
PARENT -> METABOLITE
Urine, HPLC-UV, im
IN-VIVO
URINE
Related Record Type Details
Structure of PROMETHAZINE HYDROCHLORIDE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
NIH
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