Vitas-M small molecule compound
(5Z)-1-(4-bromo-2-methylphenyl)-5-{[1-(4-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK192833
SMILES Fc1ccc(cc1)n1cccc1/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1C)Br
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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 C22H15BrFN3O2S MW 484.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15BrFN3O2S/c1-13-11-14(23)4-9-19(13)27-21(29)18(20(28)25-22(27)30)12-17-3-2-10-26(17)16-7-5-15(24)6-8-16/h2-12H,1H3,(H,25,28,30)/b18-12-InChIKey
WKAZZKJQNAASCB-PDGQHHTCSA-NSynonyms
(5Z)1(4BROMO2METHYLPHENYL)5((1(4FLUOROPHENYL)1HPYRROL2YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)1(4bromo2methylphenyl)5((1(4fluorophenyl)pyrrol2yl)methylidene)2sulfanylidene13diazinane46dione
CC1=C(C=CC(=C1)Br)N2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)F)C(=O)NC2=S
Fc1ccc(cc1)n1cccc1C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1C)Br
InChI=1SC22H15BrFN3O2Sc1131114(23)4919(13)2721(29)18(20(28)2522(27)30)1217321026(17)167515(24)6816h212H1H3(H252830)b1812
MFCD04567225
ZINC000100310865
ZINC100310865
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