AMINOPHENAZONE HEMIBARBITAL

Details

Stereochemistry	ACHIRAL
Molecular Formula	2C13H17N3O.C8H12N2O3
Molecular Weight	646.7796
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of AMINOPHENAZONE HEMIBARBITAL

Structure Search

SMILES

CCC1(CC)C(=O)NC(=O)NC1=O.CN(C)C2=C(C)N(C)N(C2=O)C3=CC=CC=C3.CN(C)C4=C(C)N(C)N(C4=O)C5=CC=CC=C5

InChI

InChIKey=MFKKTEWLBHKVQW-UHFFFAOYSA-N

InChI=1S/2C13H17N3O.C8H12N2O3/c2*1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11;1-3-8(4-2)5(11)9-7(13)10-6(8)12/h2*5-9H,1-4H3;3-4H2,1-2H3,(H2,9,10,11,12,13)

HIDE SMILES / InChI

Molecular Formula	C13H17N3O
Molecular Weight	231.2936
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C8H12N2O3
Molecular Weight	184.1925
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 `Mon Mar 31 22:02:23 GMT 2025` Edited by `admin` on `Mon Mar 31 22:02:23 GMT 2025`
Record UNII	AP1V10299G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AMINOPHENAZONE HEMIBARBITAL

Common Name

English

DIAMINOPHENAZONE BARBITAL

Preferred Name

English

2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5,5-DIETHYL-, COMPD. WITH 4-(DIMETHYLAMINO)-1,2-DIHYDRO-1,5-DIMETHYL-2-PHENYL-3H-PYRAZOL-3-ONE (1:2)

Systematic Name

English

3H-PYRAZOL-3-ONE, 4-(DIMETHYLAMINO)-1,2-DIHYDRO-1,5-DIMETHYL-2-PHENYL-, COMPD. WITH 5,5-DIETHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE (2:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

50493

Created by admin on Mon Mar 31 22:02:23 GMT 2025 , Edited by admin on Mon Mar 31 22:02:23 GMT 2025

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FDA UNII

AP1V10299G

Created by admin on Mon Mar 31 22:02:23 GMT 2025 , Edited by admin on Mon Mar 31 22:02:23 GMT 2025

PRIMARY

CAS

69401-33-8

Created by admin on Mon Mar 31 22:02:23 GMT 2025 , Edited by admin on Mon Mar 31 22:02:23 GMT 2025

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EPA CompTox

DTXSID20219531

Created by admin on Mon Mar 31 22:02:23 GMT 2025 , Edited by admin on Mon Mar 31 22:02:23 GMT 2025

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