Vitas-M small molecule compound
(5Z)-5-{[1-(3-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK175177
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cccn2c2cccc(c2)F)/C1=O
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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 C22H16FN3O4 MW 405.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16FN3O4/c1-30-18-9-7-15(8-10-18)26-21(28)19(20(27)24-22(26)29)13-17-6-3-11-25(17)16-5-2-4-14(23)12-16/h2-13H,1H3,(H,24,27,29)/b19-13-InChIKey
SKMDYQCOUXRDCL-UYRXBGFRSA-NSynonyms
(5Z)5((1(3FLUOROPHENYL)1HPYRROL2YL)METHYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)5((1(3FLUOROPHENYL)PYRROL2YL)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
COC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CN3C4=CC(=CC=C4)F)C(=O)NC2=O
COc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cccn2c2cccc(c2)F)C1=O
InChI=1SC22H16FN3O4c130189715(81018)2621(28)19(20(27)2422(26)29)1317631125(17)1652414(23)1216h213H1H3(H242729)b1913
MFCD05041069
ZINC000004704227
ZINC04704227
ZINC4704227
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