THENYLFENTANYL HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H24N2OS.ClH
Molecular Weight	364.933
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of THENYLFENTANYL HYDROCHLORIDE

Structure Search

SMILES

Cl.CCC(=O)N(C1CCN(CC2=CC=CS2)CC1)C3=CC=CC=C3

InChI

InChIKey=PXIVVZPZKLVXAH-UHFFFAOYSA-N

InChI=1S/C19H24N2OS.ClH/c1-2-19(22)21(16-7-4-3-5-8-16)17-10-12-20(13-11-17)15-18-9-6-14-23-18;/h3-9,14,17H,2,10-13,15H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula	C19H24N2OS
Molecular Weight	328.472
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Sigma non-opioid intracellular receptor 1 26 Target ID: Q99720\|\|\|Q7Z653 Gene ID: 10280.0 Gene Symbol: SIGMAR1 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/31391893	Binding Agent 1064		1185.0 nM [IC50]
Mu opioid receptor 221 Target ID: CHEMBL233 Sources: https://www.ncbi.nlm.nih.gov/pubmed/31391893	Binding Agent 1064		245.5 nM [IC50]

PubMed

Title	Date	PubMed
Affinity of fentanyl and its derivatives for the σ(1)-receptor.	2019 Jul 1	31391893

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:30:17 GMT 2023` Edited by `admin` on `Sat Dec 16 08:30:17 GMT 2023`
Record UNII	28F4PCU0PD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

THENYLFENTANYL HYDROCHLORIDE

Common Name

English

PROPANAMIDE, N-PHENYL-N-(1-(2-THIENYLMETHYL)-4-PIPERIDINYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

NIH-10493

Code

English

N-PHENYL-N-(1-(2-THIENYL)METHYL-4-PIPERIDYL)PROPANAMIDE HYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

46783063

Created by admin on Sat Dec 16 08:30:17 GMT 2023 , Edited by admin on Sat Dec 16 08:30:17 GMT 2023

PRIMARY

EPA CompTox

DTXSID4048937

Created by admin on Sat Dec 16 08:30:17 GMT 2023 , Edited by admin on Sat Dec 16 08:30:17 GMT 2023

PRIMARY

CAS

117332-93-1

Created by admin on Sat Dec 16 08:30:17 GMT 2023 , Edited by admin on Sat Dec 16 08:30:17 GMT 2023

PRIMARY

FDA UNII

28F4PCU0PD

Created by admin on Sat Dec 16 08:30:17 GMT 2023 , Edited by admin on Sat Dec 16 08:30:17 GMT 2023

PRIMARY

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ACTIVE MOIETY

Amount: