ETHYLMETHYLTHIAMBUTENE HYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H19NS2.ClH
Molecular Weight	313.909
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYLMETHYLTHIAMBUTENE HYDROCHLORIDE

Structure Search

SMILES

Cl.CCN(C)C(C)C=C(C1=CC=CS1)C2=CC=CS2

InChI

InChIKey=ISXRXBARLXCMSX-UHFFFAOYSA-N

InChI=1S/C15H19NS2.ClH/c1-4-16(3)12(2)11-13(14-7-5-9-17-14)15-8-6-10-18-15;/h5-12H,4H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula	C15H19NS2
Molecular Weight	277.448
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

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

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/13066683 | https://www.ncbi.nlm.nih.gov/pubmed/13109707

Ethylmethylthiambutene is a potent analgesic compatible with morphine. It possesses addiction liability similar to that of morphine.

CNS Activity

Originator

Approval Year

PubMed

Title	Date	PubMed
Actions and addition liability of the dithienylbutenylamines in man.	1953 Dec	13109707

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:44:39 GMT 2023` Edited by `admin` on `Sat Dec 16 08:44:39 GMT 2023`
Record UNII	KAG7WT018F
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ETHYLMETHYLTHIAMBUTENE HYDROCHLORIDE

Common Name

English

3-BUTEN-2-AMINE, N-ETHYL-N-METHYL-4,4-DI-2-THIENYL-, HYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

KAG7WT018F

Created by admin on Sat Dec 16 08:44:40 GMT 2023 , Edited by admin on Sat Dec 16 08:44:40 GMT 2023

PRIMARY

CAS

64037-50-9

Created by admin on Sat Dec 16 08:44:40 GMT 2023 , Edited by admin on Sat Dec 16 08:44:40 GMT 2023

PRIMARY

EPA CompTox

DTXSID60982015

Created by admin on Sat Dec 16 08:44:40 GMT 2023 , Edited by admin on Sat Dec 16 08:44:40 GMT 2023

PRIMARY

PUBCHEM

46423

Created by admin on Sat Dec 16 08:44:40 GMT 2023 , Edited by admin on Sat Dec 16 08:44:40 GMT 2023

PRIMARY

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Amount:


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ETHYLMETHYLTHIAMBUTENE HYDROCHLORIDE, (S)-

ENANTIOMER -> RACEMATE


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PARENT -> SALT/SOLVATE


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ETHYLMETHYLTHIAMBUTENE HYDROCHLORIDE, (R)-

ENANTIOMER -> RACEMATE

Details

SMILES

InChI

DescriptionSources: https://www.ncbi.nlm.nih.gov/pubmed/13066683 | https://www.ncbi.nlm.nih.gov/pubmed/13109707

CNS Activity

Originator

Approval Year

PubMed

Patents

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/13066683 | https://www.ncbi.nlm.nih.gov/pubmed/13109707