3-METHYL-6H-ANTHRA(9,1-CD)ISOTHIAZOL-6-ONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H9NOS
Molecular Weight	251.303
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-METHYL-6H-ANTHRA(9,1-CD)ISOTHIAZOL-6-ONE

Structure Search

SMILES

CC1=CC=C2C3=C1SN=C3C4=CC=CC=C4C2=O

InChI

InChIKey=OHUNLYWPXFRLJI-UHFFFAOYSA-N

InChI=1S/C15H9NOS/c1-8-6-7-11-12-13(16-18-15(8)12)9-4-2-3-5-10(9)14(11)17/h2-7H,1H3

HIDE SMILES / InChI

Molecular Formula	C15H9NOS
Molecular Weight	251.303
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 `Tue Apr 01 20:14:55 GMT 2025` Edited by `admin` on `Tue Apr 01 20:14:55 GMT 2025`
Record UNII	JM4H5CKU2N
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-METHYL-6H-ANTHRA(9,1-CD)ISOTHIAZOL-6-ONE

Systematic Name

English

NSC-39890

Preferred Name

English

6H-ANTHRA(9,1-CD)ISOTHIAZOL-6-ONE, 3-METHYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID00219458

Created by admin on Tue Apr 01 20:14:55 GMT 2025 , Edited by admin on Tue Apr 01 20:14:55 GMT 2025

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NSC

39890

Created by admin on Tue Apr 01 20:14:55 GMT 2025 , Edited by admin on Tue Apr 01 20:14:55 GMT 2025

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CAS

6937-72-0

Created by admin on Tue Apr 01 20:14:55 GMT 2025 , Edited by admin on Tue Apr 01 20:14:55 GMT 2025

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PUBCHEM

236866

Created by admin on Tue Apr 01 20:14:55 GMT 2025 , Edited by admin on Tue Apr 01 20:14:55 GMT 2025

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FDA UNII

JM4H5CKU2N

Created by admin on Tue Apr 01 20:14:55 GMT 2025 , Edited by admin on Tue Apr 01 20:14:55 GMT 2025

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