Vitas-M small molecule compound
5-[3-bromo-4-(naphthalen-2-ylmethoxy)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188203
SMILES S=C1NC(=O)C(=Cc2ccc(c(c2)Br)OCc2ccc3c(c2)cccc3)C(=O)N1
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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 C22H15BrN2O3S MW 467.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15BrN2O3S/c23-18-11-13(10-17-20(26)24-22(29)25-21(17)27)6-8-19(18)28-12-14-5-7-15-3-1-2-4-16(15)9-14/h1-11H,12H2,(H2,24,25,26,27,29)InChIKey
NTJHBEWNRJYXNZ-UHFFFAOYSA-NSynonyms
5((3BROMO4(NAPHTHALEN2YLMETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(3BROMO4(NAPHTHALEN2YLMETHOXY)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C1=CC=C2C=C(C=CC2=C1)COC3=C(C=C(C=C3)C=C4C(=O)NC(=S)NC4=O)Br
InChI=1SC22H15BrN2O3Sc23181113(101720(26)2422(29)2521(17)27)6819(18)2812145715312416(15)914h111H12H2(H22425262729)
MFCD02194922
ZINC000001198719
ZINC01198719
ZINC1198719
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