SECOBARBITAL, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H18N2O3
Molecular Weight	238.2829
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC[C@H](C)C1(CC=C)C(=O)NC(=O)NC1=O

InChI

InChIKey=KQPKPCNLIDLUMF-QMMMGPOBSA-N

InChI=1S/C12H18N2O3/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)/t8-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C12H18N2O3
Molecular Weight	238.2829
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:30:46 GMT 2025` Edited by `admin` on `Mon Mar 31 22:30:46 GMT 2025`
Record UNII	FG3SCI1960
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SECOBARBITAL, (S)-

Common Name

English

(-)-SECOBARBITAL

Preferred Name

English

2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-((1S)-1-METHYLBUTYL)-5-(2-PROPEN-1-YL)-

Systematic Name

English

SECOBARBITAL, (-)-

Common Name

English

(S)-(-)-SECONAL

Common Name

English

BARBITURIC ACID, 5-ALLYL-5-(1-METHYLBUTYL)-, (S)-(-)-

Common Name

English

S-(-)-SECOBARBITAL

Common Name

English

2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-((1S)-1-METHYLBUTYL)-5-(2-PROPENYL)-

Systematic Name

English

2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(1-METHYLBUTYL)-5-(2-PROPENYL)-, (S)-

Common Name

English

S(-)-SECOBARBITAL

Common Name

English

(S)-5-ALLYL-5-(2'-PENTYL)BARBITURIC ACID

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID7048873

Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025

PRIMARY

CAS

20224-45-7

Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025

PRIMARY

PUBCHEM

30019

Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025

PRIMARY

FDA UNII

FG3SCI1960

Created by admin on Mon Mar 31 22:30:46 GMT 2025 , Edited by admin on Mon Mar 31 22:30:46 GMT 2025

PRIMARY

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