Vitas-M small molecule compound
5-{[5-(2-bromo-4-methylphenyl)furan-2-yl]methylidene}-1,3-diphenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL417048
SMILES Cc1ccc(c(c1)Br)c1ccc(o1)/C=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1
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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 C28H19BrN2O3S MW 543.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H19BrN2O3S/c1-18-12-14-22(24(29)16-18)25-15-13-21(34-25)17-23-26(32)30(19-8-4-2-5-9-19)28(35)31(27(23)33)20-10-6-3-7-11-20/h2-17H,1H3InChIKey
OJPWLODAILVYII-UHFFFAOYSA-NSynonyms
5((5(2BROMO4METHYLPHENYL)FURAN2YL)METHYLIDENE)13DIPHENYL2SULFANYLIDENE13DIAZINANE46DIONE
5((5(2bromo4methylphenyl)furan2yl)methylidene)13diphenyl2thioxodihydropyrimidine46(1H5H)dione
CC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)Br
Cc1ccc(c(c1)Br)c1ccc(o1)C=C1C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1
InChI=1SC28H19BrN2O3Sc118121422(24(29)1618)25151321(3425)172326(32)30(198425919)28(35)31(27(23)33)20106371120h217H1H3
MFCD01590191
ZINC000101090854
ZINC101090854
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