OXITEFONIUM BROMIDE

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

National Institutes of Health Divider Arrow

NCATS

Possibly Marketed Outside US

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H26NO3S.Br
Molecular Weight	428.384
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of OXITEFONIUM BROMIDE

Structure Search

SMILES

[Br-].CC[N+](C)(CC)CCOC(=O)C(O)(C1=CC=CS1)C2=CC=CC=C2

InChI

InChIKey=QTBFZNSOXHKZOD-UHFFFAOYSA-M

InChI=1S/C19H26NO3S.BrH/c1-4-20(3,5-2)13-14-23-18(21)19(22,17-12-9-15-24-17)16-10-7-6-8-11-16;/h6-12,15,22H,4-5,13-14H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C19H25NO3S
Molecular Weight	347.472
Charge	0
Count

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

Molecular Formula	BrH
Molecular Weight	80.912
Charge	0
Count

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

Description
Sources: https://books.google.ru/books?id=_J2ti4EkYpkC&pg=PA2935-IA137&lpg=PA2935-IA137&dq=OXITEFONIUM&source=bl&ots=N6jyFgxLys&sig=ACfU3U3QHOylgic9K_SrhIwLXcMAjh4UzA&hl=en&sa=X&ved=2ahUKEwjtuKSgwLbhAhXwsIsKHdOGCY8Q6AEwDXoECC8QAQ#v=onepage&q=OXITEFONIUM&f=false | https://pubs.acs.org/doi/abs/10.1021/ja01180a040

Oxitefonium is an anticholinergic spasmolytic medication used for the treatment of asthma.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:15:27 GMT 2023` Edited by `admin` on `Fri Dec 15 16:15:27 GMT 2023`
Record UNII	75L83V3XCF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OXITEFONIUM BROMIDE

Official Name

English

oxitefonium bromide [INN]

Common Name

English

ETHANAMINIUM, N,N-DIETHYL-2-((2-HYDROXY-2-PHENYL-2-(2-THIENYL)ACETYL)OXY)-N-METHYL-, BROMIDE (1:1)

Systematic Name

English

DIETHYL(2-HYDROXYETHYL)METHYLAMMONIUM BROMIDE .ALPHA.-PHENYL-2-THIOPHENEGLYCOLATE

Systematic Name

English

NIBITOR

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C66880

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

Code System Code Type Description

EPA CompTox

DTXSID60938875

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

PRIMARY

SMS_ID

100000083068

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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INN

2358

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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ChEMBL

CHEMBL2111008

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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ECHA (EC/EINECS)

241-688-4

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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MESH

C001985

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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NCI_THESAURUS

C90698

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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CAS

17692-63-6

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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EVMPD

SUB09540MIG

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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PUBCHEM

71891

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

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FDA UNII

75L83V3XCF

Created by admin on Fri Dec 15 16:15:27 GMT 2023 , Edited by admin on Fri Dec 15 16:15:27 GMT 2023

PRIMARY

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