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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H24F5N3O3
Molecular Weight 545.5005
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (R)-3-(2-Amino-2-phenylethyl)-5-(2-fluoro-3-methoxyphenyl)-1-[2-fluoro-6-(trifluoromethyl)benzyl]-6-methylpyrimidine-2,4(1H,3H)-dione

SMILES

COC1=CC=CC(=C1F)C2=C(C)N(CC3=C(C=CC=C3F)C(F)(F)F)C(=O)N(C[C@H](N)C4=CC=CC=C4)C2=O

InChI

InChIKey=AEOBYHAZFRJFPZ-QFIPXVFZSA-N
InChI=1S/C28H24F5N3O3/c1-16-24(18-10-6-13-23(39-2)25(18)30)26(37)36(15-22(34)17-8-4-3-5-9-17)27(38)35(16)14-19-20(28(31,32)33)11-7-12-21(19)29/h3-13,22H,14-15,34H2,1-2H3/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H24F5N3O3
Molecular Weight 545.5005
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 19:19:06 GMT 2023
Edited
by admin
on Sat Dec 16 19:19:06 GMT 2023
Record UNII
296CMR9U5E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(R)-3-(2-Amino-2-phenylethyl)-5-(2-fluoro-3-methoxyphenyl)-1-[2-fluoro-6-(trifluoromethyl)benzyl]-6-methylpyrimidine-2,4(1H,3H)-dione
Systematic Name English
3-((R)-2-Amino-2-phenylethyl)-5-(2-fluoro-3-methoxyphenyl)-1-(2-fluoro-6-trifluoromethylbenzyl)-6-methyl-1H-pyrimidine-2,4-dione
Systematic Name English
2,4(1H,3H)-Pyrimidinedione, 3-[(2R)-2-amino-2-phenylethyl]-5-(2-fluoro-3-methoxyphenyl)-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-
Systematic Name English
3-[(2R)-2-Amino-2-phenylethyl]-5-(2-fluoro-3-methoxyphenyl)-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione
Systematic Name English
2,4(1H,3H)-Pyrimidinedione 3-[(2R)-2-amino-2-phenylethyl]-5-(2-fluoro-3-methoxyphenyl)-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-
Common Name English
Code System Code Type Description
FDA UNII
296CMR9U5E
Created by admin on Sat Dec 16 19:19:06 GMT 2023 , Edited by admin on Sat Dec 16 19:19:06 GMT 2023
PRIMARY
CAS
830346-50-4
Created by admin on Sat Dec 16 19:19:06 GMT 2023 , Edited by admin on Sat Dec 16 19:19:06 GMT 2023
PRIMARY
PUBCHEM
11421412
Created by admin on Sat Dec 16 19:19:06 GMT 2023 , Edited by admin on Sat Dec 16 19:19:06 GMT 2023
PRIMARY