4-THIOBARBITAL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H12N2O2S
Molecular Weight	200.258
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-THIOBARBITAL

Structure Search

SMILES

CCC1(CC)C(=O)NC(=O)NC1=S

InChI

InChIKey=KUMCLYGZVRXJMG-UHFFFAOYSA-N

InChI=1S/C8H12N2O2S/c1-3-8(4-2)5(11)9-7(12)10-6(8)13/h3-4H2,1-2H3,(H2,9,10,11,12,13)

HIDE SMILES / InChI

Molecular Formula	C8H12N2O2S
Molecular Weight	200.258
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 17:37:01 GMT 2025` Edited by `admin` on `Tue Apr 01 17:37:01 GMT 2025`
Record UNII	D5M4EVA9VV
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2,4(1H,3H)-PYRIMIDINEDIONE, DIHYDRO-5,5-DIETHYL-6-THIOXO-

Preferred Name

English

4-THIOBARBITAL

Common Name

English

5,5-DIETHYLDIHYDRO-6-THIOXO-2,4(1H,3H)-PYRIMIDINEDIONE

Systematic Name

English

BARBITURIC ACID, 5,5-DIETHYL-4-THIO-

Common Name

English

NSC-44137

Code

English

Code System Code Type Description

FDA UNII

D5M4EVA9VV

Created by admin on Tue Apr 01 17:37:01 GMT 2025 , Edited by admin on Tue Apr 01 17:37:01 GMT 2025

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ECHA (EC/EINECS)

228-592-8

Created by admin on Tue Apr 01 17:37:01 GMT 2025 , Edited by admin on Tue Apr 01 17:37:01 GMT 2025

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NSC

44137

Created by admin on Tue Apr 01 17:37:01 GMT 2025 , Edited by admin on Tue Apr 01 17:37:01 GMT 2025

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PUBCHEM

3034182

Created by admin on Tue Apr 01 17:37:01 GMT 2025 , Edited by admin on Tue Apr 01 17:37:01 GMT 2025

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CAS

6300-97-6

Created by admin on Tue Apr 01 17:37:01 GMT 2025 , Edited by admin on Tue Apr 01 17:37:01 GMT 2025

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EPA CompTox

DTXSID70212219

Created by admin on Tue Apr 01 17:37:01 GMT 2025 , Edited by admin on Tue Apr 01 17:37:01 GMT 2025

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