(R)-tert-Butyl (2-(5-bromo-3-(2-fluoro-6-(trifluoromethyl)benzyl)-4-methyl-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)-1-phenylethyl)carbamate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H26BrF4N3O4
Molecular Weight	600.4
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (R)-tert-Butyl (2-(5-bromo-3-(2-fluoro-6-(trifluoromethyl)benzyl)-4-methyl-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)-1-phenylethyl)carbamate

Structure Search

SMILES

CC1=C(Br)C(=O)N(C[C@H](NC(=O)OC(C)(C)C)C2=CC=CC=C2)C(=O)N1CC3=C(C=CC=C3F)C(F)(F)F

InChI

InChIKey=BYAMYPDENAIRDK-FQEVSTJZSA-N

InChI=1S/C26H26BrF4N3O4/c1-15-21(27)22(35)34(14-20(16-9-6-5-7-10-16)32-23(36)38-25(2,3)4)24(37)33(15)13-17-18(26(29,30)31)11-8-12-19(17)28/h5-12,20H,13-14H2,1-4H3,(H,32,36)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H26BrF4N3O4
Molecular Weight	600.4
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 `Sat Dec 16 19:19:47 GMT 2023` Edited by `admin` on `Sat Dec 16 19:19:47 GMT 2023`
Record UNII	LN5M2HZ59V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(R)-tert-Butyl (2-(5-bromo-3-(2-fluoro-6-(trifluoromethyl)benzyl)-4-methyl-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)-1-phenylethyl)carbamate

Systematic Name

English

Carbamic acid, [(1R)-2-[5-bromo-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]-, 1,1-dimethylethyl ester

Systematic Name

English

tert-butyl N-[(1R)-2-(5-bromo-3-{[2-fluoro-6-(trifluoromethyl)phenyl]methyl}-4-methyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl)-1-phenylethyl]carbamate

Systematic Name

English

Carbamic acid, N-[(1R)-2-[5-bromo-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]-, 1,1-dimethylethyl ester

Systematic Name

English

1,1-Dimethylethyl N-[(1R)-2-[5-bromo-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]carbamate

Systematic Name

English

Code System Code Type Description

FDA UNII

LN5M2HZ59V

Created by admin on Sat Dec 16 19:19:47 GMT 2023 , Edited by admin on Sat Dec 16 19:19:47 GMT 2023

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EPA CompTox

DTXSID90109978

Created by admin on Sat Dec 16 19:19:47 GMT 2023 , Edited by admin on Sat Dec 16 19:19:47 GMT 2023

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PUBCHEM

21018401

Created by admin on Sat Dec 16 19:19:47 GMT 2023 , Edited by admin on Sat Dec 16 19:19:47 GMT 2023

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CAS

830346-49-1

Created by admin on Sat Dec 16 19:19:47 GMT 2023 , Edited by admin on Sat Dec 16 19:19:47 GMT 2023

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