Ethyl 2-[2-[[(aminoiminomethyl)thio]methyl]-4-bromophenoxy]acetate hydrochloride

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H15BrN2O3S.ClH
Molecular Weight	383.689
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ethyl 2-[2-[[(aminoiminomethyl)thio]methyl]-4-bromophenoxy]acetate hydrochloride

Structure Search

SMILES

Cl.CCOC(=O)COC1=CC=C(Br)C=C1CSC(N)=N

InChI

InChIKey=QOFVDSDUMHJDEV-UHFFFAOYSA-N

InChI=1S/C12H15BrN2O3S.ClH/c1-2-17-11(16)6-18-10-4-3-9(13)5-8(10)7-19-12(14)15;/h3-5H,2,6-7H2,1H3,(H3,14,15);1H

HIDE SMILES / InChI

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

Molecular Formula	C12H15BrN2O3S
Molecular Weight	347.228
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:29:49 GMT 2023` Edited by `admin` on `Fri Dec 15 17:29:49 GMT 2023`
Record UNII	NRX6H422MS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Ethyl 2-[2-[[(aminoiminomethyl)thio]methyl]-4-bromophenoxy]acetate hydrochloride

Systematic Name

English

Acetic acid, [2-[[(aminoiminomethyl)thio]methyl]-4-bromophenoxy]-, ethyl ester, monohydrochloride

Common Name

English

Acetic acid, 2-[2-[[(aminoiminomethyl)thio]methyl]-4-bromophenoxy]-, ethyl ester, hydrochloride (1:1)

Common Name

English

Aminoiminomethyl)thio)methyl)-4-bromophenoxy)acetic acid ethyl ester, (2-(((

Common Name

English

Acetic acid, [[α-(amidinothio)-4-bromo-o-tolyl]oxy]-, ethyl ester, monohydrochloride

Common Name

English

[C-[[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]methylsulfanyl]carbonimidoyl]azanium,chloride

Systematic Name

English

Code System Code Type Description

PUBCHEM

27727

Created by admin on Fri Dec 15 17:29:49 GMT 2023 , Edited by admin on Fri Dec 15 17:29:49 GMT 2023

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EPA CompTox

DTXSID60936553

Created by admin on Fri Dec 15 17:29:49 GMT 2023 , Edited by admin on Fri Dec 15 17:29:49 GMT 2023

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FDA UNII

NRX6H422MS

Created by admin on Fri Dec 15 17:29:49 GMT 2023 , Edited by admin on Fri Dec 15 17:29:49 GMT 2023

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CAS

16158-46-6

Created by admin on Fri Dec 15 17:29:49 GMT 2023 , Edited by admin on Fri Dec 15 17:29:49 GMT 2023

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