Vitas-M small molecule compound

(5Z)-5-{3-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-4-methoxybenzylidene}-1-(2-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK526706
SMILES COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H18FN3O6 MW 499.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18FN3O6/c1-37-22-11-10-15(12-16(22)14-30-24(33)17-6-2-3-7-18(17)25(30)34)13-19-23(32)29-27(36)31(26(19)35)21-9-5-4-8-20(21)28/h2-13H,14H2,1H3,(H,29,32,36)/b19-13-
InChIKey
PEAXRAADWHSNCY-UYRXBGFRSA-N
Synonyms
373374-63-1
(5Z)5((3((13DIOXOISOINDOL2YL)METHYL)4METHOXYPHENYL)METHYLIDENE)1(2FLUOROPHENYL)13DIAZINANE246TRIONE
(5Z)5(3((13dioxo13dihydro2Hisoindol2yl)methyl)4methoxybenzylidene)1(2fluorophenyl)pyrimidine246(1H3H5H)trione
(Z)5(3((13dioxoisoindolin2yl)methyl)4methoxybenzylidene)1(2fluorophenyl)pyrimidine246(1H3H5H)trione
373374631
COC1=C(C=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3F)CN4C(=O)C5=CC=CC=C5C4=O
COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)C=C1C(=O)NC(=O)N(C1=O)c1ccccc1F
InChI=1SC27H18FN3O6c13722111015(1216(22)143024(33)17623718(17)25(30)34)131923(32)2927(36)31(26(19)35)21954820(21)28h213H14H21H3(H293236)b1913
MFCD01947129
ZINC000013773612
ZINC13773612

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Available files

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