LAURYLPYRIDINIUM 5-CHLORO-2-MERCAPTOBENZOTHIAZOLE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H30N.C7H3ClNS2
Molecular Weight	449.115
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of LAURYLPYRIDINIUM 5-CHLORO-2-MERCAPTOBENZOTHIAZOLE

Structure Search

SMILES

ClC1=CC=C2SC(=S)[N-]C2=C1.CCCCCCCCCCCC[N+]3=CC=CC=C3

InChI

InChIKey=NPUUGQIQOUWACG-UHFFFAOYSA-M

InChI=1S/C17H30N.C7H4ClNS2/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18;8-4-1-2-6-5(3-4)9-7(10)11-6/h11,13-14,16-17H,2-10,12,15H2,1H3;1-3H,(H,9,10)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C7H4ClNS2
Molecular Weight	201.696
Charge	0
Count

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

Molecular Formula	C17H30N
Molecular Weight	248.4268
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 18:51:31 GMT 2025` Edited by `admin` on `Mon Mar 31 18:51:31 GMT 2025`
Record UNII	I79832L455
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LAURYLPYRIDINIUM 5-CHLORO-2-MERCAPTOBENZOTHIAZOLE

Systematic Name

English

VANCIDE 26

Preferred Name

English

5-CHLORO-2-MERCAPTOBENZOTHIAZOLE 1-LAURYLPYRIDINIUM SALT

Common Name

English

NSC-5337

Code

English

PYRIDINIUM, 1-DODECYL-, SALT WITH 5-CHLORO-2(3H)- BENZOTHIAZOLETHIONE (1:1)

Common Name

English

PYRIDINIUM, 1-DODECYL-, SALT WITH 5-CHLORO-2- BENZOTHIAZOLETHIOL (1:1)

Common Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

51703