aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate

C99H88ClF8N11O12 — CID 158694088

IUPACaniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate
SMILESCCOC(=O)c1c(C)nc(-c2c(F)cccc2F)nc1Cc1ccccc1.CCOC(=O)c1c(C)nc(-c2c(F)cccc2F)nc1Cl.CCOC(=O)c1c(C=O)nc(-c2c(F)cccc2F)nc1Cc1ccccc1.COc1ccc(CN)c(OC)c1.COc1ccc(CN2Cc3nc(-c4c(F)cccc4F)nc(Cc4ccccc4)c3C2=O)c(OC)c1.Nc1ccccc1
InChIInChI=1S/C28H23F2N3O3.C21H16F2N2O3.C21H18F2N2O2.C14H11ClF2N2O2.C9H13NO2.C6H7N/c1-35-19-12-11-18(24(14-19)36-2)15-33-16-23-26(28(33)34)22(13-17-7-4-3-5-8-17)31-27(32-23)25-20(29)9-6-10-21(25)30;1-2-28-21(27)19-16(11-13-7-4-3-5-8-13)24-20(25-17(19)12-26)18-14(22)9-6-10-15(18)23;1-3-27-21(26)18-13(2)24-20(19-15(22)10-7-11-16(19)23)25-17(18)12-14-8-5-4-6-9-14;1-3-21-14(20)10-7(2)18-13(19-12(10)15)11-8(16)5-4-6-9(11)17;1-11-8-4-3-7(6-10)9(5-8)12-2;7-6-4-2-1-3-5-6/h3-12,14H,13,15-16H2,1-2H3;3-10,12H,2,11H2,1H3;4-11H,3,12H2,1-2H3;4-6H,3H2,1-2H3;3-5H,6,10H2,1-2H3;1-5H,7H2
InChIKeyIGSGFXZBAZHDQZ-UHFFFAOYSA-N
MW1811.29 g/mol
LogP19.68
Rot. Bonds24

About aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate

aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate (PubChem CID 158694088) has the molecular formula C99H88ClF8N11O12 and a molecular weight of 1811.29 g/mol. Its IUPAC name is aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate.

Molecular Properties

Compound Nameaniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate
PubChem CID158694088
Molecular FormulaC99H88ClF8N11O12
Molecular Weight1811.29 g/mol
Exact Mass1809.62
IUPAC Nameaniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate
SMILESCCOC(=O)c1c(C)nc(-c2c(F)cccc2F)nc1Cc1ccccc1.CCOC(=O)c1c(C)nc(-c2c(F)cccc2F)nc1Cl.CCOC(=O)c1c(C=O)nc(-c2c(F)cccc2F)nc1Cc1ccccc1.COc1ccc(CN)c(OC)c1.COc1ccc(CN2Cc3nc(-c4c(F)cccc4F)nc(Cc4ccccc4)c3C2=O)c(OC)c1.Nc1ccccc1
InChIInChI=1S/C28H23F2N3O3.C21H16F2N2O3.C21H18F2N2O2.C14H11ClF2N2O2.C9H13NO2.C6H7N/c1-35-19-12-11-18(24(14-19)36-2)15-33-16-23-26(28(33)34)22(13-17-7-4-3-5-8-17)31-27(32-23)25-20(29)9-6-10-21(25)30;1-2-28-21(27)19-16(11-13-7-4-3-5-8-13)24-20(25-17(19)12-26)18-14(22)9-6-10-15(18)23;1-3-27-21(26)18-13(2)24-20(19-15(22)10-7-11-16(19)23)25-17(18)12-14-8-5-4-6-9-14;1-3-21-14(20)10-7(2)18-13(19-12(10)15)11-8(16)5-4-6-9(11)17;1-11-8-4-3-7(6-10)9(5-8)12-2;7-6-4-2-1-3-5-6/h3-12,14H,13,15-16H2,1-2H3;3-10,12H,2,11H2,1H3;4-11H,3,12H2,1-2H3;4-6H,3H2,1-2H3;3-5H,6,10H2,1-2H3;1-5H,7H2
InChIKeyIGSGFXZBAZHDQZ-UHFFFAOYSA-N
XLogP19.68
TPSA308.36 Ų
H-Bond Donors2
H-Bond Acceptors22
Rotatable Bonds24
Heavy Atoms131
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001811.29
LogP ≤ 519.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate with MolForge

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Related Compounds

tert-butyl 2-[4-[[2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-5-oxo-7H-pyrrolo[3,4-d]pyrimidin-4-yl]amino]phenyl]-2,4-dimethyl-3-oxopiperazine-1-carboxylate
CID 118348248
ethyl 2-[4-[[2-(2-chloro-6-fluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-5-oxo-7H-pyrrolo[3,4-d]pyrimidin-4-yl]amino]phenyl]acetate
CID 121336059
4-[4-[2-[4-[[4-chloro-2-(2,6-difluorophenyl)-5-oxo-7H-pyrrolo[3,4-d]pyrimidin-6-yl]methyl]-3-methoxyphenyl]peroxy-1,1,1-trifluoropropan-2-yl]anilino]-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one
CID 122520345
2-[3-[[2-(4-aminophenyl)-2,4-dimethyl-3-oxopiperazin-1-yl]methyl]-2,6-difluorophenyl]-4-chloro-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one
CID 130383448
tert-butyl 3-[2-[4-[[4-chloro-2-(2,6-difluorophenyl)-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]methyl]-3-methoxyphenoxy]ethyl]-6-[[2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-5-oxo-7H-pyrrolo[3,4-b]pyridin-4-yl]amino]-3-methyl-2H-pyrrolo[2,3-b]pyridine-1-carboxylate
CID 145146701
2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[4-(trifluoromethoxy)phenyl]methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;2-(2,6-difluorophenyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]-6,7-dihydropyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 2-(2,6-difluorophenyl)-4-formyl-6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidine-5-carboxylate;ethyl 2-(2,6-difluorophenyl)-4-methyl-6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidine-5-carboxylate;4-methoxyaniline
CID 158242521
Tert-butyl 3-[4-[[2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-5-oxo-6,7-dihydrocyclopenta[d]pyrimidin-4-yl]methyl]phenyl]-2-oxopiperidine-1-carboxylate;2-(2,6-difluorophenyl)-4-[[4-(2-oxopiperidin-3-yl)phenyl]methyl]-6,7-dihydropyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 2-(2,6-difluorophenyl)-4-formyl-6-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxopiperidin-3-yl]phenyl]methyl]pyrimidine-5-carboxylate
CID 157134928
2-(4-aminophenyl)-N-ethyl-2-methylpropanamide;carbanide;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;2-[4-[[2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-5-oxo-7H-pyrrolo[3,4-d]pyrimidin-4-yl]methyl]phenyl]-N-ethyl-2-methylpropanamide;2-[4-[[2-(2,6-difluorophenyl)-5-oxo-6,7-dihydropyrrolo[3,4-d]pyrimidin-4-yl]methyl]phenyl]-N-ethyl-2-methylpropanamide;N-ethyl-2-methyl-2-(4-nitrophenyl)propanamide;palladium
CID 157410145
carbanide;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[4-(2-methoxyethoxy)phenyl]methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 2-(2,6-difluorophenyl)-4-formyl-6-[[4-(2-methoxyethoxy)phenyl]methyl]pyrimidine-5-carboxylate;ethyl 2-(2,6-difluorophenyl)-4-[[4-(2-methoxyethoxy)phenyl]methyl]-6-methylpyrimidine-5-carboxylate;1-fluoro-4-nitrobenzene;methane;methanol;2-methoxyethanol;4-(2-methoxyethoxy)aniline;1-(2-methoxyethoxy)-4-nitrobenzene;palladium;selenium dioxide
CID 157410753
(3S)-3-(4-aminophenyl)-1,3,5,5-tetramethylpyrrolidin-2-one;3-(4-aminophenyl)-1,3,5,5-tetramethylpyrrolidin-2-one;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[4-[(3S)-1,3,5,5-tetramethyl-2-oxopyrrolidin-3-yl]phenyl]methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;2-(2,6-difluorophenyl)-4-[[4-[(3S)-1,3,5,5-tetramethyl-2-oxopyrrolidin-3-yl]phenyl]methyl]-6,7-dihydropyrrolo[3,4-d]pyrimidin-5-one;methane
CID 157462779
2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[4-(2-methyl-3-oxobutan-2-yl)phenyl]methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;2-(2,6-difluorophenyl)-4-[[4-(2-methyl-3-oxobutan-2-yl)phenyl]methyl]-6,7-dihydropyrrolo[3,4-d]pyrimidin-5-one;2-[4-[[2-(2,6-difluorophenyl)-5-oxo-6,7-dihydropyrrolo[3,4-d]pyrimidin-4-yl]methyl]phenyl]-2-methylpropanoic acid;(2,4-dimethoxyphenyl)methanamine;ethyl 2-(4-aminophenyl)-2-methylpropanoate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 2-(2,6-difluorophenyl)-4-formyl-6-[[4-(2-methyl-3-oxobutan-2-yl)phenyl]methyl]pyrimidine-5-carboxylate;ethyl 2-(2,6-difluorophenyl)-4-methyl-6-[[4-(2-methyl-3-oxobutan-2-yl)phenyl]methyl]pyrimidine-5-carboxylate;hydrate
CID 157515083
bromo acetate;tert-butyl 2-(4-aminophenyl)-2,4-dimethyl-3-oxopiperazine-1-carboxylate;tert-butyl 3-[4-[[2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-5-oxo-7H-pyrrolo[3,4-d]pyrimidin-4-yl]methyl]phenyl]-1,3-dimethyl-2-oxopiperidine-4-carboxylate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;2-(2,6-difluorophenyl)-4-[[4-(1,3-dimethyl-2-oxopiperidin-3-yl)phenyl]methyl]-6,7-dihydropyrrolo[3,4-d]pyrimidin-5-one
CID 157558201

Frequently Asked Questions

What is the IUPAC name of aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate?
The IUPAC name of aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate (CID 158694088) is aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate.
What is the SMILES notation for aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate?
The canonical SMILES for aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate is CCOC(=O)c1c(C)nc(-c2c(F)cccc2F)nc1Cc1ccccc1.CCOC(=O)c1c(C)nc(-c2c(F)cccc2F)nc1Cl.CCOC(=O)c1c(C=O)nc(-c2c(F)cccc2F)nc1Cc1ccccc1.COc1ccc(CN)c(OC)c1.COc1ccc(CN2Cc3nc(-c4c(F)cccc4F)nc(Cc4ccccc4)c3C2=O)c(OC)c1.Nc1ccccc1.
What is the InChIKey of aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate?
The InChIKey is IGSGFXZBAZHDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23F2N3O3.C21H16F2N2O3.C21H18F2N2O2.C14H11ClF2N2O2.C9H13NO2.C6H7N/c1-35-19-12-11-18(24(14-19)36-2)15-33-16-23-26(28(33)34)22(13-17-7-4-3-5-8-17)31-27(32-23)25-20(29)9-6-10-21(25)30;1-2-28-21(27)19-16(11-13-7-4-3-5-8-13)24-20(25-17(19)12-26)18-14(22)9-6-10-15(18)23;1-3-27-21(26)18-13(2)24-20(19-15(22)10-7-11-16(19)23)25-17(18)12-14-8-5-4-6-9-14;1-3-21-14(20)10-7(2)18-13(19-12(10)15)11-8(16)5-4-6-9(11)17;1-11-8-4-3-7(6-10)9(5-8)12-2;7-6-4-2-1-3-5-6/h3-12,14H,13,15-16H2,1-2H3;3-10,12H,2,11H2,1H3;4-11H,3,12H2,1-2H3;4-6H,3H2,1-2H3;3-5H,6,10H2,1-2H3;1-5H,7H2.
What are the key properties of aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate?
aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate has a molecular weight of 1811.29 g/mol, XLogP of 19.68, 24 rotatable bonds, 2 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for aniline;4-benzyl-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-d]pyrimidin-5-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-formylpyrimidine-5-carboxylate;ethyl 4-benzyl-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate;ethyl 4-chloro-2-(2,6-difluorophenyl)-6-methylpyrimidine-5-carboxylate is sourced from PubChem (CID 158694088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).