Quinazoline, 2-((2-benzothiazolylthio)methyl)-4-methyl-, 3-oxide

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H13N3OS2
Molecular Weight	339.435
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Quinazoline, 2-((2-benzothiazolylthio)methyl)-4-methyl-, 3-oxide

Structure Search

SMILES

CC1=C2C=CC=CC2=NC(CSC3=NC4=CC=CC=C4S3)=N1=O

InChI

InChIKey=IIVRSDOBYSDZIQ-UHFFFAOYSA-N

InChI=1S/C17H13N3OS2/c1-11-12-6-2-3-7-13(12)18-16(20(11)21)10-22-17-19-14-8-4-5-9-15(14)23-17/h2-9H,10H2,1H3

HIDE SMILES / InChI

Molecular Formula	C17H13N3OS2
Molecular Weight	339.435
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 12:38:20 GMT 2023` Edited by `admin` on `Sat Dec 16 12:38:20 GMT 2023`
Record UNII	RG58GY2G4K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Quinazoline, 2-((2-benzothiazolylthio)methyl)-4-methyl-, 3-oxide

Systematic Name

English

NSC-64057

Code

English

2-[(4-Methyl-3-oxidoquinazolin-3-ium-2-yl)methylsulfanyl]-1,3-benzothiazole

Systematic Name

English

Code System Code Type Description

PUBCHEM

461818

Created by admin on Sat Dec 16 12:38:20 GMT 2023 , Edited by admin on Sat Dec 16 12:38:20 GMT 2023

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CAS

6965-83-9

Created by admin on Sat Dec 16 12:38:20 GMT 2023 , Edited by admin on Sat Dec 16 12:38:20 GMT 2023

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NSC

64057

Created by admin on Sat Dec 16 12:38:20 GMT 2023 , Edited by admin on Sat Dec 16 12:38:20 GMT 2023

PRIMARY

EPA CompTox

DTXSID40219917

Created by admin on Sat Dec 16 12:38:20 GMT 2023 , Edited by admin on Sat Dec 16 12:38:20 GMT 2023

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FDA UNII

RG58GY2G4K

Created by admin on Sat Dec 16 12:38:20 GMT 2023 , Edited by admin on Sat Dec 16 12:38:20 GMT 2023

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