Vitas-M small molecule compound
2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK557553
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccc(c(c2)O)O)nc2c(c1=O)c1CCCCc1s2
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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 C25H22N2O5S2 MW 494.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5S2/c1-32-16-9-7-15(8-10-16)27-24(31)22-17-4-2-3-5-21(17)34-23(22)26-25(27)33-13-20(30)14-6-11-18(28)19(29)12-14/h6-12,28-29H,2-5,13H2,1H3InChIKey
PCOLEAZIIXVUGW-UHFFFAOYSA-NSynonyms
575467-48-02((2(34dihydroxyphenyl)2oxoethyl)sulfanyl)3(4methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((2(34dihydroxyphenyl)2oxoethyl)thio)3(4methoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2(2(34dihydroxyphenyl)2oxoethyl)sulfanyl3(4methoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
575467480
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC(=C(C=C4)O)O)SC5=C3CCCC5
InChI=1SC25H22N2O5S2c132169715(81016)2724(31)2217423521(17)3423(22)2625(27)331320(30)1461118(28)19(29)1214h6122829H2513H21H3
MFCD03223484
ZINC000002375564
ZINC02375564
ZINC2375564
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