4,4'-((5-BROMO-2-((4-CYANOPHENYL)AMINO)PYRIMIDINE-4,6-DIYL)BIS(OXY))BIS(3,5-DIMETHYLBENZONITRILE)

Details

Stereochemistry	ACHIRAL
Molecular Formula	C29H21BrN6O2
Molecular Weight	565.42
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,4'-((5-BROMO-2-((4-CYANOPHENYL)AMINO)PYRIMIDINE-4,6-DIYL)BIS(OXY))BIS(3,5-DIMETHYLBENZONITRILE)

Structure Search

SMILES

CC1=CC(=CC(C)=C1OC2=NC(NC3=CC=C(C=C3)C#N)=NC(OC4=C(C)C=C(C=C4C)C#N)=C2Br)C#N

InChI

InChIKey=WXJWJJMTWABFNY-UHFFFAOYSA-N

InChI=1S/C29H21BrN6O2/c1-16-9-21(14-32)10-17(2)25(16)37-27-24(30)28(38-26-18(3)11-22(15-33)12-19(26)4)36-29(35-27)34-23-7-5-20(13-31)6-8-23/h5-12H,1-4H3,(H,34,35,36)

HIDE SMILES / InChI

Molecular Formula	C29H21BrN6O2
Molecular Weight	565.42
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 18:40:49 GMT 2023` Edited by `admin` on `Sat Dec 16 18:40:49 GMT 2023`
Record UNII	WXV8E3E3C6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4,4'-((5-BROMO-2-((4-CYANOPHENYL)AMINO)PYRIMIDINE-4,6-DIYL)BIS(OXY))BIS(3,5-DIMETHYLBENZONITRILE)

Systematic Name

English

BENZONITRILE, 4,4'-((5-BROMO-2-((4-CYANOPHENYL)AMINO)-4,6-PYRIMIDINEDIYL)BIS(OXY))BIS(3,5-DIMETHYL-

Common Name

English

ETRAVIRINE IMPURITY 6

Common Name

English

Code System Code Type Description

CAS

1704730-70-0

Created by admin on Sat Dec 16 18:40:49 GMT 2023 , Edited by admin on Sat Dec 16 18:40:49 GMT 2023

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FDA UNII

WXV8E3E3C6

Created by admin on Sat Dec 16 18:40:49 GMT 2023 , Edited by admin on Sat Dec 16 18:40:49 GMT 2023

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PUBCHEM

162623936

Created by admin on Sat Dec 16 18:40:49 GMT 2023 , Edited by admin on Sat Dec 16 18:40:49 GMT 2023

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