2-(((4-Methyl-3-oxido-2,3-dihydro-2-quinazolinyl)methyl)thio)ethanol

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H14N2O2S
Molecular Weight	250.317
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(((4-Methyl-3-oxido-2,3-dihydro-2-quinazolinyl)methyl)thio)ethanol

Structure Search

SMILES

CC1=C2C=CC=CC2=NC(CSCCO)=[N+]1[O-]

InChI

InChIKey=CKKKMBQXGUQQAC-UHFFFAOYSA-N

InChI=1S/C12H14N2O2S/c1-9-10-4-2-3-5-11(10)13-12(14(9)16)8-17-7-6-15/h2-5,15H,6-8H2,1H3

HIDE SMILES / InChI

Molecular Formula	C12H14N2O2S
Molecular Weight	250.317
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 12:55:22 GMT 2023` Edited by `admin` on `Sat Dec 16 12:55:22 GMT 2023`
Record UNII	9X9AWC3SE6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-(((4-Methyl-3-oxido-2,3-dihydro-2-quinazolinyl)methyl)thio)ethanol

Systematic Name

English

NSC-64053

Code

English

Ethanol, 2-[[(4-methyl-3-oxido-2-quinazolinyl)methyl]thio]-

Systematic Name

English

Code System Code Type Description

FDA UNII

9X9AWC3SE6

Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023

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CAS

6965-81-7

Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023

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EPA CompTox

DTXSID20219915

Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023

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PUBCHEM

494009

Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023

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NSC

64053

Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023

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