Vitas-M small molecule compound
2-{3-bromo-4-[(2-fluorobenzyl)oxy]-5-methoxyphenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK090387
SMILES COc1cc(cc(c1OCc1ccccc1F)Br)c1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C24H20BrFN2O3S MW 515.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrFN2O3S/c1-30-18-11-14(10-16(25)21(18)31-12-13-6-2-4-8-17(13)26)22-27-23(29)20-15-7-3-5-9-19(15)32-24(20)28-22/h2,4,6,8,10-11H,3,5,7,9,12H2,1H3,(H,27,28,29)InChIKey
MPTGBFNNBNFZAN-UHFFFAOYSA-NSynonyms
2(3bromo4((2fluorobenzyl)oxy)5methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3bromo4((2fluorophenyl)methoxy)5methoxyphenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
COC1=C(C(=CC(=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)Br)OCC5=CC=CC=C5F
COc1cc(cc(c1OCc1ccccc1F)Br)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC24H20BrFN2O3Sc130181114(1016(25)21(18)311213624817(13)26)222723(29)2015735919(15)3224(20)2822h24681011H357912H21H3(H272829)
MFCD02297250
STK090387
ZINC000010013421
ZINC10013421
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