Vitas-M small molecule compound
(5E)-1-(3-chloro-2-methylphenyl)-5-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK160711
SMILES O=C1NC(=O)N(C(=O)/C/1=C/c1cccn1c1ccccc1F)c1cccc(c1C)Cl
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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 C22H15ClFN3O3 MW 423.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClFN3O3/c1-13-16(23)7-4-10-18(13)27-21(29)15(20(28)25-22(27)30)12-14-6-5-11-26(14)19-9-3-2-8-17(19)24/h2-12H,1H3,(H,25,28,30)/b15-12+InChIKey
BGEVWICMRYPYRF-NTCAYCPXSA-NSynonyms
(5E)1(3CHLORO2METHYLPHENYL)5((1(2FLUOROPHENYL)1HPYRROL2YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5E)1(3chloro2methylphenyl)5((1(2fluorophenyl)pyrrol2yl)methylidene)13diazinane246trione
CC1=C(C=CC=C1Cl)N2C(=O)C(=CC3=CC=CN3C4=CC=CC=C4F)C(=O)NC2=O
InChI=1SC22H15ClFN3O3c11316(23)741018(13)2721(29)15(20(28)2522(27)30)1214651126(14)19932817(19)24h212H1H3(H252830)b1512+
MFCD08671426
O=C1NC(=O)N(C(=O)C1=Cc1cccn1c1ccccc1F)c1cccc(c1C)Cl
ZINC000009845923
ZINC09845923
ZINC9845923
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