ALBITIAZOLIUM BROMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H42N2O2S2.2Br
Molecular Weight	614.54
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Br-].[Br-].CC1=C(CCO)SC=[N+]1CCCCCCCCCCCC[N+]2=CSC(CCO)=C2C

InChI

InChIKey=AFJCGBHHSKAACR-UHFFFAOYSA-L

InChI=1S/C24H42N2O2S2.2BrH/c1-21-23(13-17-27)29-19-25(21)15-11-9-7-5-3-4-6-8-10-12-16-26-20-30-24(14-18-28)22(26)2;;/h19-20,27-28H,3-18H2,1-2H3;2*1H/q+2;;/p-2

HIDE SMILES / InChI

Molecular Formula	C24H40N2O2S2
Molecular Weight	452.717
Charge	0
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 `Fri Dec 15 16:15:20 UTC 2023` Edited by `admin` on `Fri Dec 15 16:15:20 UTC 2023`
Record UNII	3AC0AJ4ILP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALBITIAZOLIUM BROMIDE

Official Name

English

albitiazolium bromide [INN]

Common Name

English

3,3'-(DODECAN-1,12-DIYL)BIS(5-(2-HYDROXYETHYL)-4-METHYL-1,3-THIAZOL-3-IUM) DIBROMIDE

Systematic Name

English

SAR97276A

Code

English

SAR-97276A

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C271