Vitas-M small molecule compound
5-{2-[(2-chloro-6-fluorobenzyl)oxy]benzylidene}-1,3-diphenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK393930
SMILES O=C1/C(=C/c2ccccc2OCc2c(F)cccc2Cl)/C(=O)N(C(=S)N1c1ccccc1)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 C30H20ClFN2O3S MW 543.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H20ClFN2O3S/c31-25-15-9-16-26(32)24(25)19-37-27-17-8-7-10-20(27)18-23-28(35)33(21-11-3-1-4-12-21)30(38)34(29(23)36)22-13-5-2-6-14-22/h1-18H,19H2InChIKey
OLIUHCSFAJHGFN-UHFFFAOYSA-NSynonyms
5((2((2CHLORO6FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)13DIPHENYL2SULFANYLIDENE13DIAZINANE46DIONE
5((2((6CHLORO2FLUOROPHENYL)METHOXY)PHENYL)METHYLENE)13DIPHENYL2THIOXO13DIHYDROPYRIMIDINE46DIONE
5(2((2chloro6fluorobenzyl)oxy)benzylidene)13diphenyl2thioxodihydropyrimidine46(1H5H)dione
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CC=C3OCC4=C(C=CC=C4Cl)F)C(=O)N(C2=S)C5=CC=CC=C5
InChI=1SC30H20ClFN2O3Sc31251591626(32)24(25)19372717871020(27)182328(35)33(21113141221)30(38)34(29(23)36)22135261422h118H19H2
MFCD03649395
O=C1C(=Cc2ccccc2OCc2c(F)cccc2Cl)C(=O)N(C(=S)N1c1ccccc1)c1ccccc1
ZINC000101093742
ZINC101093742
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