3-[(6-ethoxy-1,3-benzothiazol-2-yl)diazenyl]pentane-2,4-dione

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H15N3O3S
Molecular Weight	305.352
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 3-[(6-ethoxy-1,3-benzothiazol-2-yl)diazenyl]pentane-2,4-dione

Structure Search

SMILES

CCOC1=CC=C2N=C(SC2=C1)\N=N\C(C(C)=O)C(C)=O

InChI

InChIKey=JFPHQUYDPNVDHM-WUKNDPDISA-N

InChI=1S/C14H15N3O3S/c1-4-20-10-5-6-11-12(7-10)21-14(15-11)17-16-13(8(2)18)9(3)19/h5-7,13H,4H2,1-3H3/b17-16+

HIDE SMILES / InChI

Molecular Formula	C14H15N3O3S
Molecular Weight	305.352
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:16:40 GMT 2025` Edited by `admin` on `Tue Apr 01 20:16:40 GMT 2025`
Record UNII	WH22DLU4HU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-306777

Preferred Name

English

3-[(6-ethoxy-1,3-benzothiazol-2-yl)diazenyl]pentane-2,4-dione

Systematic Name

English

2,4-PENTANEDIONE, 3-((6-ETHOXY-2-BENZOTHIAZOLYL)AZO)-

Systematic Name

English

2,4-Pentanedione, 3-[2-(6-ethoxy-2-benzothiazolyl)diazenyl]-

Systematic Name

English

3-[2-(6-Ethoxy-2-benzothiazolyl)diazenyl]-2,4-pentanedione

Systematic Name

English

3-((6-ethoxybenzothiazol-2-yl)azo)-2,4-pentanedione

Systematic Name

English

3-[(1E)-2-(6-ethoxy-1,3-benzothiazol-2-yl)diazen-1-yl]pentane-2,4-dione

Systematic Name

English

Code System Code Type Description

CAS

4882-90-0

Created by admin on Tue Apr 01 20:16:40 GMT 2025 , Edited by admin on Tue Apr 01 20:16:40 GMT 2025

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FDA UNII

WH22DLU4HU

Created by admin on Tue Apr 01 20:16:40 GMT 2025 , Edited by admin on Tue Apr 01 20:16:40 GMT 2025

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NSC

306777

Created by admin on Tue Apr 01 20:16:40 GMT 2025 , Edited by admin on Tue Apr 01 20:16:40 GMT 2025

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EPA CompTox

DTXSID7063635

Created by admin on Tue Apr 01 20:16:40 GMT 2025 , Edited by admin on Tue Apr 01 20:16:40 GMT 2025

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