SEPANTRONIUM BROMIDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H19N4O3.Br
Molecular Weight	443.294
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SEPANTRONIUM BROMIDE

Structure Search

SMILES

[Br-].COCC[N+]1=C(C)N(CC2=NC=CN=C2)C3=C1C(=O)C4=CC=CC=C4C3=O

InChI

InChIKey=QBIYUDDJPRGKNJ-UHFFFAOYSA-M

InChI=1S/C20H19N4O3.BrH/c1-13-23(9-10-27-2)17-18(24(13)12-14-11-21-7-8-22-14)20(26)16-6-4-3-5-15(16)19(17)25;/h3-8,11H,9-10,12H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C20H19N4O3
Molecular Weight	363.3899
Charge	1
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:00:26 UTC 2023` Edited by `admin` on `Sat Dec 16 16:00:26 UTC 2023`
Record UNII	7H5Q4J1CM5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SEPANTRONIUM BROMIDE

Official Name

English

Sepantronium bromide [WHO-DD]

Common Name

English

SEPANTRONIUM BROMIDE [USAN]

Common Name

English

SEPANTRONIUM BROMIDE [JAN]

Common Name

English

YM155

Code

English

YM-155

Code

English

1H-NAPHTH(2,3-D)IMIDAZOLIUM, 4,9-DIHYDRO-1-(2-METHOXYETHYL)-2-METHYL-4,9-DIOXO-3-(2-PYRAZINYLMETHYL)-, BROMIDE (1:1)

Systematic Name

English

sepantronium bromide [INN]

Common Name

English

1-(2-METHOXYETHYL)-2-METHYL-4,9-DIOXO-3-((PYRAZIN-2-YL)METHYL)-4,9-DIHYDRO-1H-NAPHTHO(2,3-D)IMIDAZOLIUM BROMIDE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C2189

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

Code System Code Type Description

CHEBI

139608

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

FDA UNII

7H5Q4J1CM5

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

NCI_THESAURUS

C61091

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

USAN

XX-165

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

SMS_ID

100000163523

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

EVMPD

SUB177829

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

EPA CompTox

DTXSID90228817

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

CAS

781661-94-7

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

ChEMBL

CHEMBL2110734

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

INN

9463

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

PUBCHEM

11178236

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

MESH

C523798

Created by admin on Sat Dec 16 16:00:26 UTC 2023 , Edited by admin on Sat Dec 16 16:00:26 UTC 2023

PRIMARY

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