ETHYLMETHYLTHIAMBUTENE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H19NS2
Molecular Weight	277.448
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYLMETHYLTHIAMBUTENE

Structure Search

SMILES

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

InChI

InChIKey=MORSAEFGQPDBKM-UHFFFAOYSA-N

InChI=1S/C15H19NS2/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

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	( + / - )

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

PubMed

Title	Date	PubMed

Patents

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:55:14 GMT 2023` Edited by `admin` on `Sat Dec 16 16:55:14 GMT 2023`
Record UNII	722BFZ899Q
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ETHYLMETHYLTHIAMBUTENE

Official Name

English

NIH-5145

Common Name

English

N-ETHYL-N,1-DIMETHYL-3,3-DI-2-THIENYLALLYLAMINE

Systematic Name

English

IDS-NE-004

Code

English

1C50

Code

English

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

Systematic Name

English

3-ETHYLMETHYLAMINO-1,1-DI-(2'-THIENYL)-1-BUTENE

Common Name

English

ACSCN-9623

Common Name

English

ALLYLAMINE, N-ETHYL-N,1-DIMETHYL-3,3-DI-2-THIENYL-

Systematic Name

English

ETHYLMETHYLTHIAMBUTENE [MI]

Common Name

English

EMETHIBUTIN

Common Name

English

ethylmethylthiambutene [INN]

Common Name

English

Classification Tree Code System Code

DEA NO.

9623

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

NCI_THESAURUS

C241

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

Code System Code Type Description

ECHA (EC/EINECS)

207-128-8

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

PRIMARY

EPA CompTox

DTXSID60861937

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

PRIMARY

SMS_ID

100000082050

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

PRIMARY

INN

316

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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CAS

441-61-2

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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EVMPD

SUB07292MIG

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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DRUG BANK

DB01468

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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MERCK INDEX

m1139

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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Merck Index

WIKIPEDIA

ETHYLMETHYLTHIAMBUTENE

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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PUBCHEM

46424

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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NCI_THESAURUS

C65569

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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FDA UNII

722BFZ899Q

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

PRIMARY

ChEMBL

CHEMBL2106526

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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DRUG CENTRAL

3206

Created by admin on Sat Dec 16 16:55:15 GMT 2023 , Edited by admin on Sat Dec 16 16:55:15 GMT 2023

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Related Record Type Details


					KAG7WT018F

ETHYLMETHYLTHIAMBUTENE HYDROCHLORIDE

SALT/SOLVATE -> PARENT

Comments:

APPROXIMATE PURE ANHYDROUS DRUG CONTENT (IN PERCENT)

Amount:


					YK6360ECH4

ETHYLMETHYLTHIAMBUTENE, (R)-

ENANTIOMER -> RACEMATE


					0T28I95616

ETHYLMETHYLTHIAMBUTENE, (S)-

ENANTIOMER -> RACEMATE

Related Record Type Details


					722BFZ899Q

ETHYLMETHYLTHIAMBUTENE

ACTIVE MOIETY