Vitas-M small molecule compound
(5Z)-1-(4-bromo-2-methylphenyl)-5-[(5-methylfuran-2-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK197500
SMILES Brc1ccc(c(c1)C)N1C(=S)NC(=O)/C(=C/c2ccc(o2)C)/C1=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 C17H13BrN2O3S MW 405.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrN2O3S/c1-9-7-11(18)4-6-14(9)20-16(22)13(15(21)19-17(20)24)8-12-5-3-10(2)23-12/h3-8H,1-2H3,(H,19,21,24)/b13-8-InChIKey
KJPJKKOYAVAXNS-JYRVWZFOSA-NSynonyms
(5Z)1(4BROMO2METHYLPHENYL)5((5METHYLFURAN2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(4BROMO2METHYLPHENYL)5((5METHYLFURAN2YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
Brc1ccc(c(c1)C)N1C(=S)NC(=O)C(=Cc2ccc(o2)C)C1=O
CC1=CC=C(O1)C=C2C(=O)NC(=S)N(C2=O)C3=C(C=C(C=C3)Br)C
InChI=1SC17H13BrN2O3Sc19711(18)4614(9)2016(22)13(15(21)1917(20)24)8125310(2)2312h38H12H3(H192124)b138
MFCD02379658
ZINC000012363800
ZINC12363800
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