Vitas-M small molecule compound

(5E)-1-(4-fluorobenzyl)-2-hydroxy-5-[4-(propan-2-yl)benzylidene]pyrimidine-4,6(1H,5H)-dione

Catalog ID
STL039263
SMILES Fc1ccc(cc1)CN1C(=NC(=O)/C(=C\c2ccc(cc2)C(C)C)/C1=O)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 C21H19FN2O3 MW 366.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN2O3/c1-13(2)16-7-3-14(4-8-16)11-18-19(25)23-21(27)24(20(18)26)12-15-5-9-17(22)10-6-15/h3-11,13H,12H2,1-2H3,(H,23,25,27)/b18-11+
InChIKey
IHYHOTTVORKUSR-WOJGMQOQSA-N
Synonyms
374090-13-8
(5E)1((4FLUOROPHENYL)METHYL)5((4PROPAN2YLPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4fluorobenzyl)2hydroxy5(4(propan2yl)benzylidene)pyrimidine46(1H5H)dione
374090138
CC(C)C1=CC=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=C(C=C3)F
Fc1ccc(cc1)CN1C(=NC(=O)C(=Cc2ccc(cc2)C(C)C)C1=O)O
InChI=1SC21H19FN2O3c113(2)167314(4816)111819(25)2321(27)24(20(18)26)12155917(22)10615h31113H12H212H3(H232527)b1811+
MFCD03795481
ZINC000001294918
ZINC1294918

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Available files

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