COUMARIN 6

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H18N2O2S
Molecular Weight	350.434
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of COUMARIN 6

Structure Search

SMILES

CCN(CC)C1=CC=C2C=C(C3=NC4=CC=CC=C4S3)C(=O)OC2=C1

InChI

InChIKey=VBVAVBCYMYWNOU-UHFFFAOYSA-N

InChI=1S/C20H18N2O2S/c1-3-22(4-2)14-10-9-13-11-15(20(23)24-17(13)12-14)19-21-16-7-5-6-8-18(16)25-19/h5-12H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C20H18N2O2S
Molecular Weight	350.434
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 11:56:49 GMT 2023` Edited by `admin` on `Sat Dec 16 11:56:49 GMT 2023`
Record UNII	48DU8Q9UAU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

COUMARIN 6

Common Name

English

2H-1-BENZOPYRAN-2-ONE, 3-(2-BENZOTHIAZOLYL)-7-(DIETHYLAMINO)-

Systematic Name

English

NK-1858

Code

English

COUMARIN 540

Common Name

English

3-BENZOTHIAZOL-2-YL-7-DIETHYLAMINO-CHROMEN-2-ONE

Systematic Name

English

NSC-290432

Code

English

3-(2-BENZOTHIAZOLYL)-7-(DIETHYLAMINO)COUMARIN

Systematic Name

English

3-(2-BENZOTHIAZOLYL)-7-(DIETHYLAMINO)-2H-1-BENZOPYRAN-2-ONE

Systematic Name

English

COUMARIN, 3-(2-BENZOTHIAZOLYL)-7-(DIETHYLAMINO)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

100334

Created by admin on Sat Dec 16 11:56:49 GMT 2023 , Edited by admin on Sat Dec 16 11:56:49 GMT 2023

PRIMARY

FDA UNII

48DU8Q9UAU

Created by admin on Sat Dec 16 11:56:49 GMT 2023 , Edited by admin on Sat Dec 16 11:56:49 GMT 2023

PRIMARY

CAS

38215-36-0

Created by admin on Sat Dec 16 11:56:49 GMT 2023 , Edited by admin on Sat Dec 16 11:56:49 GMT 2023

PRIMARY

EPA CompTox

DTXSID5068079

Created by admin on Sat Dec 16 11:56:49 GMT 2023 , Edited by admin on Sat Dec 16 11:56:49 GMT 2023

PRIMARY

ECHA (EC/EINECS)

253-830-2

Created by admin on Sat Dec 16 11:56:49 GMT 2023 , Edited by admin on Sat Dec 16 11:56:49 GMT 2023

PRIMARY

NSC

290432

Created by admin on Sat Dec 16 11:56:49 GMT 2023 , Edited by admin on Sat Dec 16 11:56:49 GMT 2023

PRIMARY

CHEBI

51942

Created by admin on Sat Dec 16 11:56:49 GMT 2023 , Edited by admin on Sat Dec 16 11:56:49 GMT 2023

PRIMARY

Related Record Type Details


					X9H949X2X5

COUMARIN 6 HYDROCHLORIDE

SALT/SOLVATE -> PARENT

Amount: