4(3H)-PYRIMIDINONE, 2-((4-(5-BROMO-3-METHYL-2-PYRIDINYL)BUTYL)AMINO)-5-(HYDROXY(6-METHYL-3-PYRIDINYL)METHYL)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C21H24BrN5O2
Molecular Weight	458.352
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4(3H)-PYRIMIDINONE, 2-((4-(5-BROMO-3-METHYL-2-PYRIDINYL)BUTYL)AMINO)-5-(HYDROXY(6-METHYL-3-PYRIDINYL)METHYL)-

Structure Search

SMILES

CC1=NC=C(C=C1)C(O)C2=CNC(NCCCCC3=C(C)C=C(Br)C=N3)=NC2=O

InChI

InChIKey=JNFRUWBVALYOFF-UHFFFAOYSA-N

InChI=1S/C21H24BrN5O2/c1-13-9-16(22)11-25-18(13)5-3-4-8-23-21-26-12-17(20(29)27-21)19(28)15-7-6-14(2)24-10-15/h6-7,9-12,19,28H,3-5,8H2,1-2H3,(H2,23,26,27,29)

HIDE SMILES / InChI

Molecular Formula	C21H24BrN5O2
Molecular Weight	458.352
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:23:51 GMT 2023` Edited by `admin` on `Sat Dec 16 15:23:51 GMT 2023`
Record UNII	DC7YHH9LE0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4(3H)-PYRIMIDINONE, 2-((4-(5-BROMO-3-METHYL-2-PYRIDINYL)BUTYL)AMINO)-5-(HYDROXY(6-METHYL-3-PYRIDINYL)METHYL)-

Systematic Name

English

SKF 94955

Common Name

English

4(1H)-PYRIMIDINONE, 2-((4-(5-BROMO-3-METHYL-2-PYRIDINYL)BUTYL)AMINO)-5-(HYDROXY(6-METHYL-3-PYRIDINYL)METHYL)-

Systematic Name

English

2-((4-(5-BROMO-3-METHYL-2-PYRIDINYL)BUTYL)AMINO)-5-(HYDROXY(6-METHYL-3-PYRIDINYL)METHYL)-4(3H)-PYRIMIDINONE

Systematic Name

English

SK&F 94955

Common Name

English

Code System Code Type Description

CAS

120729-26-2

Created by admin on Sat Dec 16 15:23:51 GMT 2023 , Edited by admin on Sat Dec 16 15:23:51 GMT 2023

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PUBCHEM

146014890

Created by admin on Sat Dec 16 15:23:51 GMT 2023 , Edited by admin on Sat Dec 16 15:23:51 GMT 2023

PRIMARY

FDA UNII

DC7YHH9LE0

Created by admin on Sat Dec 16 15:23:51 GMT 2023 , Edited by admin on Sat Dec 16 15:23:51 GMT 2023

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