Vitas-M small molecule compound
5-{3,5-dichloro-4-[(4-fluorobenzyl)oxy]benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK191578
SMILES O=C1NC(=S)NC(=O)C1=Cc1cc(Cl)c(c(c1)Cl)OCc1ccc(cc1)F
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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 C18H11Cl2FN2O3S MW 425.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11Cl2FN2O3S/c19-13-6-10(5-12-16(24)22-18(27)23-17(12)25)7-14(20)15(13)26-8-9-1-3-11(21)4-2-9/h1-7H,8H2,(H2,22,23,24,25,27)InChIKey
HBAOKWBRQDXTMH-UHFFFAOYSA-NSynonyms
340304-97-4(5E)5(35DICHLORO4((4FLUOROBENZYL)OXY)BENZYLIDENE)6HYDROXY2SULFANYLPYRIMIDIN4(5H)ONE
5((35DICHLORO4((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(35DICHLORO4((4FLUOROBENZYL)OXY)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C1=CC(=CC=C1COC2=C(C=C(C=C2Cl)C=C3C(=O)NC(=S)NC3=O)Cl)F
InChI=1SC18H11Cl2FN2O3Sc1913610(51216(24)2218(27)2317(12)25)714(20)15(13)26891311(21)429h17H8H2(H22223242527)
MFCD02194701
ZINC2594515
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