Vitas-M small molecule compound
5-({2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187407
SMILES S=C1NC(=O)C(=Cc2cc(n(c2C)c2ccccc2C(F)(F)F)C)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 C18H14F3N3O2S MW 393.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14F3N3O2S/c1-9-7-11(8-12-15(25)22-17(27)23-16(12)26)10(2)24(9)14-6-4-3-5-13(14)18(19,20)21/h3-8H,1-2H3,(H2,22,23,25,26,27)InChIKey
OXMJRPUJLBSXMK-UHFFFAOYSA-NSynonyms
327085-32-5327085325
5((25DIMETHYL1(2(TRIFLUOROMETHYL)PHENYL)1HPYRROL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((25DIMETHYL1(2(TRIFLUOROMETHYL)PHENYL)PYRROL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1C2=CC=CC=C2C(F)(F)F)C)C=C3C(=O)NC(=S)NC3=O
InChI=1SC18H14F3N3O2Sc19711(81215(25)2217(27)2316(12)26)10(2)24(9)14643513(14)18(1920)21h38H12H3(H22223252627)
MFCD02707551
ZINC000002994594
ZINC02994594
ZINC2994594
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