THIAZOLE ORANGE DIMER

Details

Stereochemistry	ACHIRAL
Molecular Formula	C49H58N6S2.4I
Molecular Weight	1302.773
Optical Activity	NONE
Defined Stereocenters	0 / 2
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[I-].[I-].[I-].[I-].CN1C2=CC=CC=C2S\C1=C/C3=C4C=CC=CC4=[N+](CCC[N+](C)(C)CCC[N+](C)(C)CCC[N+]5=C6C=CC=CC6=C(\C=C7/SC8=CC=CC=C8N7C)C=C5)C=C3

InChI

InChIKey=MZZINWWGSYUHGU-UHFFFAOYSA-J

InChI=1S/C49H58N6S2.4HI/c1-50-44-22-11-13-24-46(44)56-48(50)36-38-26-30-52(42-20-9-7-18-40(38)42)28-15-32-54(3,4)34-17-35-55(5,6)33-16-29-53-31-27-39(41-19-8-10-21-43(41)53)37-49-51(2)45-23-12-14-25-47(45)57-49;;;;/h7-14,18-27,30-31,36-37H,15-17,28-29,32-35H2,1-6H3;4*1H/q+4;;;;/p-4

HIDE SMILES / InChI

Molecular Formula	C49H58N6S2
Molecular Weight	795.155
Charge	4
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	2
Optical Activity	NONE

Molecular Formula	I
Molecular Weight	126.90447
Charge	-1
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 `Mon Mar 31 19:54:08 GMT 2025` Edited by `admin` on `Mon Mar 31 19:54:08 GMT 2025`
Record UNII	AE28YH62UF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

THIAZOLE ORANGE DIMER

Common Name

English

TOTO-1

Preferred Name

English

1,1'-(1,3-PROPANEDIYLBIS((DIMETHYLIMINO)-3,1-PROPANEDIYL))BIS(4-(3-METHYL-2(3H)-BENZOTHIAZOLYLIDENE)METHYL)QUINOLINIUM TETRAIODIDE

Systematic Name

English

TOTO

Common Name

English

THIAZOLE ORANGE DIMER [MI]

Common Name

English

QUINOLINIUM, 1,1'-(1,3-PROPANEDIYLBIS((DIMETHYLIMINIO)-3,1-PROPANEDIYL))BIS(4-((3-METHYL-2(3H)-BENZOTHIAZOLYLIDENE)METHYL)-, IODIDE (1:4)

Systematic Name

English

Code System Code Type Description

CAS

143413-84-7

Created by admin on Mon Mar 31 19:54:08 GMT 2025 , Edited by admin on Mon Mar 31 19:54:08 GMT 2025

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PUBCHEM

6439463

Created by admin on Mon Mar 31 19:54:08 GMT 2025 , Edited by admin on Mon Mar 31 19:54:08 GMT 2025

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MERCK INDEX

m10730

Created by admin on Mon Mar 31 19:54:08 GMT 2025 , Edited by admin on Mon Mar 31 19:54:08 GMT 2025

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FDA UNII

AE28YH62UF

Created by admin on Mon Mar 31 19:54:08 GMT 2025 , Edited by admin on Mon Mar 31 19:54:08 GMT 2025

PRIMARY